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Leancare Ltd.


Web: http://www.leancare.co.uk
Address: Greenfield Business Centre. Greenfield. Holywell. Flintshire., Hollywell, Fintshire, United kingdom
Phone: +(44) 7587 049 029 | Fax: +(33) 494 863 170 | Map/Directions >>

Profile: Leancare Ltd. serves industries such as pharmaceutical and fine-chemical industries. Our product line includes bis(pinacolato)diboron, 3,4-ethylenedioxythiophene, fluoroquinolone intermediates, fluorobenzoic acid/fluoroaniline derivatives and malonyl dichloride. We supply vitamin B12, vitamin D3, beta-carotene (provitamin A, D-cycloserine and 6-fluoroindole. Our 2-deoxy-D-ribose is used in carbohydrate chemistry. Our 1-(1-naphthyl) ethylamine is an important reagent in amino-acid and peptide chemistry.

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• (2-Aminothiazol-4-yl)hydroxyimino acetic acid
IUPAC Name: 2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoacetic acid | CAS Registry Number: 66338-96-3
Synonyms: 2-(2-Aminothiazole-4-yl)-2-hydroxyiminoacetic acid, CTK5C4296, ANW-54069, AG-G-50218, KB-162296, A835426, 2-(2-amino-4-thiazolyl)-2-hydroxyiminoacetic acid, 4-Thiazoleacetic acid,2-amino-a-(hydroxyimino)-, (aZ)-, (Z)-2-(2-AMINOTHIAZOL-4-YL)-2-HYDROXYIMINOACETIC ACID, 2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanoic acid, 4-Thiazoleaceticacid, 2-amino-a-(hydroxyimino)-,(Z)-;(Z)-2-(2-Aminothiazol-4-yl)-2-(hydroxyimino)acetic acid;(Z)-2-Amino-a-(hydroxyimino)-4-thiazoleaceticacid;

Molecular Formula: C5H5N3O3SMolecular Weight: 187.176500 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: URGSBEYHHRKMJL-UHFFFAOYSA-N

• (S)-2-Tetrahydrofuroic acid
IUPAC Name: (2S)-oxolane-2-carboxylic acid | CAS Registry Number: 87392-07-2
Synonyms: (S)-(-)-2-Tetrahydrofuroic Acid, (S)-(-)-Tetrahydro-2-furoic acid, (2S)-oxolane-2-carboxylic acid, (S)-(-)-2-Carboxytetrahydrofuroic acid, (S)-tetrahydro-2-furoic acid, (S)-(-)-Tetrahydrofuran-2-carboxylic Acid, AG-H-52599, TFB, 2-Furancarboxylic acid, tetrahydro-, PubChem5795, SureCN239908, AC1L9JY0, AC1Q71BL, UNII-0I2B46K2SJ, (-)-Tetrahydro-2-furoic acid, (2S)-2-oxolanecarboxylic acid, 527890_ALDRICH, CTK3J6635, MolPort-001-792-498, Tetrahydro-2-furoic acid, (-)-

Molecular Formula: C5H8O3Molecular Weight: 116.115220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UJJLJRQIPMGXEZ-BYPYZUCNSA-N

• (3-Trifluoromethylpyrid-2-yl)hydrazine
IUPAC Name: [3-(trifluoromethyl)pyridin-2-yl]hydrazine | CAS Registry Number: 89570-83-2
Synonyms: TPC-PY081, ZINC02379404, CID2777776, 12P-663

Molecular Formula: C6H6F3N3Molecular Weight: 177.127150 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: TWPMJXZSKBAITM-UHFFFAOYSA-N

• (S,S)-2-Azabicyclo[3,3,0]octane-3-carboxylic acid benzylester hydrochloride
IUPAC Name: benzyl (2S,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate;hydrochloride | CAS Registry Number: 93779-29-4
Synonyms: (S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzylester hydrochloride, (S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzyl ester HCL, MolPort-003-983-932, AKOS016010451, RL05890, AK117081, (2S,6aS)-Benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride

Molecular Formula: C15H20ClNO2Molecular Weight: 281.777800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HLXCXOQXUDRJLF-JJARTYCRSA-N

• (S,S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzylester hydrochloride
IUPAC Name: benzyl (2S,3aS,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate | CAS Registry Number: 93779-31-8
Synonyms: (2S,3aS,6aS)-Benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate, (S,S,S)-2-Azabicyclo[3,3,0]-octane-carboxylic acid benzylester hydrochloride, (S)-BENZYL ENDO, CIS-2-AZABICYCLO [3,3,0]OCTANECARBOXYLATE, PubChem5980, SureCN2001189, CYC086, CTK8B5013, ACT01825, ANW-47035, AKOS015998608, AB21138, RP17579, AK-76391, KB-206592, FT-0642251, BENZYL (1S,3S,5S)-2-AZABICYCLO[3.3.0]OCTANE-3-CARBOXYLATE, Cyclopenta[b]pyrrole-2-carboxylic acid, octahydro-, phenylmethyl ester, (2S,3aS,6aS)-, CYCLOPENTA[B]PYRROLE-2-CARBOXYLIC ACID, OCTAHYDRO-, PHENYLMETHYL ESTER, (2S,3AS,6AS)-

Molecular Formula: C15H19NO2Molecular Weight: 245.316860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KEDWLCOPRDSQBB-IHRRRGAJSA-N

• 1,1-Dichloroacetone
IUPAC Name: 1,1-dichloropropan-2-one | CAS Registry Number: 513-88-2
Synonyms: 2-Propanone, 1,1-dichloro-, 1,1-Dichloro-2-propanone, sGQDBHaQBS]Tp@, Dichloromethyl methyl ketone, alpha,alpha-Dichloroacetone, 1,1-DICHLOROPROPANONE, .alpha.,.alpha.-Dichloroacetone, CCRIS 1941, 442210_SUPELCO, 10877_FLUKA, EINECS 208-175-7, 1,1-DCA, NSC 42725, NSC42725, BRN 1740214, ZINC01675518, AI3-52312, LS-122838, 4-01-00-03218 (Beilstein Handbook Reference), InChI=1/C3H4Cl2O/c1-2(6)3(4)5/h3H,1H

Molecular Formula: C3H4Cl2OMolecular Weight: 126.969260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CSVFWMMPUJDVKH-UHFFFAOYSA-N

• 2,2-Diphenyl-L-Prolinol
IUPAC Name: di(phenyl)-[(2S)-pyrrolidin-1-ium-2-yl]methanol | CAS Registry Number: 112068-01-6
Synonyms: ZINC03632772

Molecular Formula: C17H20NO+Molecular Weight: 254.346800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: OGCGXUGBDJGFFY-INIZCTEOSA-O

• (S)-(-)-3-Amino-1,2-propandiol
IUPAC Name: (2S)-3-aminopropane-1,2-diol | CAS Registry Number: 61278-21-5
Synonyms: (S)-3-Amino-1,2-propanediol, (S)-3-Aminopropane-1,2-diol, (S)-(-)-3-Amino-1,2-propanediol, AG-E-54014, (S)-(-)-3-AMINO-1,2-PROPANDIOL, 209849-99-0, AC1L9A5G, C3H9NO2, KSC496I7P, 473960_ALDRICH, (2S)-2,3-Dihydroxypropylamine, CTK3J6477, MolPort-003-934-096, ACN-S003732, ACT02383, ANW-33750, (2S)-3-Amino-1,2-dihydroxypropane, AKOS005138002, AC-7162, AG-G-23119

Molecular Formula: C3H9NO2Molecular Weight: 91.109060 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: KQIGMPWTAHJUMN-VKHMYHEASA-N

• 1,10-decanediamine
IUPAC Name: decane-1,10-diamine | CAS Registry Number: 646-25-3
Synonyms: 1,10-Diaminodecane, Decyldiamine, 1,10-Decanediamine, Decamethylenediamine, 1,10-Decamethylenediamine, Lopac-D14204, Lopac0_000458, D14204_ALDRICH, WLN: Z10Z, 32880_FLUKA, EINECS 211-471-9, NSC 10400, NSC10400, BRN 1738591, PDSP1_000331, PDSP2_000329, NCGC00015388-01, NCGC00093873-01, NCGC00093873-02, LS-59288

Molecular Formula: C10H24N2Molecular Weight: 172.310960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YQLZOAVZWJBZSY-UHFFFAOYSA-N

• 1,1'-Binaphthyl
IUPAC Name: 1-naphthalen-1-ylnaphthalene | CAS Registry Number: 604-53-5
Synonyms: 1,1'-Binaphthalene, 1,1'-BINAPHTHYL, Di-alpha-naphthol, 1,1'-Dinaphthyl, BINAPHTHALENE, Di-.alpha.-naphthol, Nickel-based cobalt alloy, alpha,alpha'-Dinaphthylene, NSC662279, AIDS143029, AIDS-143029, CID11789, NSC15230, EINECS 210-070-6, NSC 15230, AI3-18146, ST5405532, TL8003826, 11068-27-2, 32507-32-7

Molecular Formula: C20H14Molecular Weight: 254.325160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZDZHCHYQNPQSGG-UHFFFAOYSA-N

• 4-Methoxyphenoxyacetic Acid
IUPAC Name: 2-(4-methoxyphenoxy)acetic acid | CAS Registry Number: 1877-75-4
Synonyms: 4-Methoxyphenoxyacetic acid, (4-Methoxyphenoxy)acetic acid, Acetic acid, (4-methoxyphenoxy)-, TimTec1_002918, 2-(4-Methoxyphenoxy)acetic acid, Acetic acid, (p-methoxyphenoxy)-, ARONIS003308, NSC4255, ALBB-000232, CID74649, NSC 4255, NSC45652, EINECS 217-513-2, NSC 45652, STK069462, Acetic acid, 2-(4-methoxyphenoxy)-, AI3-10592, AC-907/25014254, T5410447

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BHFSBJHPPFJCOS-UHFFFAOYSA-N

• (3-Bromo-2,4,6-Trimethylphenylcarbamoyl)Methyliminodiacetic Acid
IUPAC Name: 2-[[2-(3-bromo-2,4,6-trimethylanilino)-2-oxoethyl]-(carboxymethyl)amino]acetic acid | CAS Registry Number: 78266-06-5
Synonyms: Choletec, MEBROFENIN, Mebrofenine, Mebrofenino, Mebrofeninum, Mebrofenine [INN-French], Mebrofeninum [INN-Latin], Mebrofenino [INN-Spanish], Mebrofenin (USAN/INN), Mebrofenin [USAN:INN], UNII-7PV0B6ED98, EINECS 278-877-6, CID54158, SQ 26962, NCGC00181297-01, LS-72341, SQ-26962, D04869, ((((3-Bromomesityl)carbamoyl)methyl)imino)diacetic acid, Glycine, N-(2-((3-bromo-2,4,6-trimethylphenyl)amino)-2-oxoethyl)-N-(carboxymethyl)-

Molecular Formula: C15H19BrN2O5Molecular Weight: 387.225760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: MHPZZZZLAQGTHT-UHFFFAOYSA-N

• 1,2,3,4-Tetrahydro-7-Hydroxy-6-Methoxy-3-Isoquinoline Carboxylic Acid
IUPAC Name: 7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid | CAS Registry Number: 76824-93-6
Synonyms: 1,2,3,4-TETRAHYDRO-7-HYDROXY-6-METHOXY-3-ISOQUINOLINE CARBOXYLIC ACID, AG-H-06815, 7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid, 1,2,3,4-Tetrahydro-7-hydroxy-6-methoxy-3-isoquinoline carboyxlic acid, AGN-PC-00MFVL, CTK2H5653, RW1228, AKOS015961200, AB21208, AC-13376, AK-36332, KB-09927, FT-0080536, FT-0650893, A838851, 1,2,3,4-Tetrahydro-7-hydroxy-6-methoxy-3-isoquinolinecarboxylic acid, 1,2,3,4-Tetrahydro-7-hydroxy-6-methoxy-3-isoquinolinecarboyxlic acid, 3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-, 3-Isoquinolinecarboxylicacid, 1,2,3,4-tetrahydro-7-hydroxy-6-methoxy-, 6-methoxy-7-oxidanyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Molecular Formula: C11H13NO4Molecular Weight: 223.225220 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: WBDSVFTUSBMMLD-UHFFFAOYSA-N

• (+)-2-Carene
IUPAC Name: (1R,6R)-4,7,7-trimethylbicyclo[4.1.0]hept-4-ene | CAS Registry Number: 4497-92-1

Molecular Formula: C10H16Molecular Weight: 136.234040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IBVJWOMJGCHRRW-RKDXNWHRSA-N

• (-)-Epicatechin gallate
IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate | CAS Registry Number: 1257-08-5
Synonyms: L-Epicatechin gallate, Epicatechol, gallate, (-)-Epicatechin-3-gallate, Spectrum_000314, SpecPlus_000275, (-)-Epicatechin-3-O-gallate, Spectrum2_000165, Spectrum3_000246, Spectrum4_001540, Spectrum5_000080, Epicatechol, gallate (6CI), BSPBio_001632, KBioGR_001980, KBioSS_000794, SPECTRUM210238, DivK1c_006371, SPBio_000029, E3893_SIAL, MEGxp0_000810, Epicatechol, 3-gallate, (-)-

Molecular Formula: C22H18O10Molecular Weight: 442.372320 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 10

InChIKey: LSHVYAFMTMFKBA-TZIWHRDSSA-N

• 4-Nitrophthalamide
IUPAC Name: 4-nitrobenzene-1,2-dicarboxamide | CAS Registry Number: 13138-53-9
Synonyms: 4-Nitrophthaldiamide, Maybridge1_003271, NCIOpen2_006090, 330426_ALDRICH, 1,2-Benzenedicarboxamide, 4-nitro-, NSC94821, EINECS 236-070-6, NSC 94821, ZINC00056712, ST5319938, SR-01000643795-1

Molecular Formula: C8H7N3O4Molecular Weight: 209.158880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XWCDSCYRIROFIO-UHFFFAOYSA-N

• (2S)-2-Aminobutyramide
IUPAC Name: (2S)-2-aminobutanamide | CAS Registry Number: 143164-46-9
Synonyms: (2S)-2-aminobutyramide, PubChem5725, CTK4C3518, MolPort-003-983-915, AKOS006274147, AG-D-85412, FT-0643354, I14-4102

Molecular Formula: C4H10N2OMolecular Weight: 102.135000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HNNJFUDLLWOVKZ-VKHMYHEASA-N

• (1S,2R)-N-Benzyl-2-amino-1,2-diphenylethanol
IUPAC Name: (1S,2R)-2-(benzylamino)-1,2-diphenylethanol | CAS Registry Number: 153322-12-4
Synonyms: AC1OG9EG, CTK4C7804, ACT08967, ZINC19944864, AKOS015909791, AC-6569, AG-E-00904, FT-0643503, (1S,2R)-2-(benzylamino)-1,2-diphenylethanol, (1S,2R)-2-Benzylamino-1,2-diphenyl-ethanol, (1s,2r)-1,2-diphenyl-2-[benzylamino]ethan-1-ol, I14-32763, Benzeneethanol, |A-phenyl-|A-[(phenylmethyl)amino]-, (|AS,|AR)-, Benzeneethanol,a-phenyl-b-[(phenylmethyl)amino]-,[S-(R*,S*)]-;(1S,2R)-2-(Benzylamino)-1,2-diphenylethanol;(1S,2R)-2-Benzylamino-1,2-diphenyl-ethanol;(1S,2R)-N-Benzyl-2-amino-1,2-diphenylethanol;

Molecular Formula: C21H21NOMolecular Weight: 303.397540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KKJGAZRIFJEPKA-RTWAWAEBSA-N

• (R)-(-)-Ethyl nipecotate-L-tartrate
IUPAC Name: (3S)-2,3-dihydroxybutanedioic acid;ethyl (3R)-piperidine-3-carboxylate | CAS Registry Number: 167392-57-6
Synonyms: AKOS015950961, AB1007056, A810860, (3S)-2,3-bis(oxidanyl)butanedioic acid; ethyl (3R)-piperidine-3-carboxylate, (3S)-2,3-dihydroxybutanedioic acid; (3R)-3-piperidinecarboxylic acid ethyl ester

Molecular Formula: C12H21NO8Molecular Weight: 307.297040 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 9

InChIKey: HHPGQKZOPPDLNH-RATVZYDNSA-N

• (S)-(-)-Alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid
IUPAC Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid | CAS Registry Number: 17257-71-5
Synonyms: Mosher's acid, MTPA, (+)-Mtpa, 156558_ALDRICH, 65371_FLUKA, EINECS 241-292-1, EINECS 243-829-5, NSC370475, SBB000723, ST5307071, TL80073733, alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, ()-alpha-Methoxy-alpha-trifluoromethylphenylacetic acid, (R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid, (+)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, (-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, Benzeneacetic acid, alpha-methoxy-alpha-(trifluoromethyl)-, (-)-.alpha.-Methoxy-.alpha.-trifluoromethylphenylacetic acid, (S)-(-)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetic acid, Benzeneacetic acid, .alpha.-methoxy-.alpha.-(trifluoromethyl)-, (R)-

Molecular Formula: C10H9F3O3Molecular Weight: 234.171870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: JJYKJUXBWFATTE-UHFFFAOYSA-N

• (S)-4-Phenyl-1,3-thiazolidine-2-thione
IUPAC Name: (4S)-4-phenyl-1,3-thiazolidine-2-thione | CAS Registry Number: 185137-29-5
Synonyms: (S)-4-Phenylthiazolidine-2-thione, (4S)-4-phenyl-1,3-thiazolidine-2-thione, 39911_FLUKA, CTK4D8931, MolPort-001-757-842, ACT02351, ANW-73062, ZINC15021158, AKOS006344722, AG-E-34528, OR14520, S-4-Phenyl-1,3-thiazolidine-2-thione, AK109099, KB-211571

Molecular Formula: C9H9NS2Molecular Weight: 195.304460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IEXSISKCCADMLK-MRVPVSSYSA-N

• 3-Cyano-2-hydroxy-4-methoxypyridine
IUPAC Name: 4-methoxy-2-oxo-1H-pyridine-3-carbonitrile | CAS Registry Number: 21642-98-8
Synonyms: ZINC00168323, CID2786702, TL8006950, 2K-028, 1,2-Dihydro-4-methoxy-2-oxo-3-pyridinecarbonitrile, 4-Methoxy-2-oxo-1,2-dihydro-pyridine-3-carbonitrile, 3-Pyridinecarbonitrile, 1,2-dihydro-4-methoxy-2-oxo-

Molecular Formula: C7H6N2O2Molecular Weight: 150.134740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MWGIDWPSRDMIQN-UHFFFAOYSA-N

• (R)-1,2,3,4-tetr-Ahydro naphthoic acid
IUPAC Name: (1R)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid | CAS Registry Number: 23357-47-3
Synonyms: (R)-1,2,3,4-tetrahedro-naphthoic acid, (R)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid, (R)-1,2,3,4-Tetrahedronaphthoic acid, (R)-1,2,3,4-Tetrahydro-naphthoic acid, PubChem5734, SureCN2792830, Jsp004700, CTK1A1753, MolPort-003-983-916, ANW-61708, AKOS006344682, AG-E-68012, RP23790, (R)-1,2,3,4-Tetrahydronaphthoic acid, (S)-1,2,3,4-tetrahedro-naphthoic acid, AC-19121, AK-34255, KB-209579, TL8006317, FT-0600924

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VDLWTJCSPSUGOA-SNVBAGLBSA-N

• (S)-1-(Thiophen-2-yl)ethanol
IUPAC Name: (1S)-1-thiophen-2-ylethanol | CAS Registry Number: 27948-39-6
Synonyms: (1S)-1-(2-Thienyl)ethanol, AC1Q29NP, SureCN3892567, (S)-1-(thiophen-2-yl)ethanol, 00791_FLUKA, CTK4G0525, MolPort-013-830-047, ZINC06030436, (1S)-|A-Methyl-2-thiophenemethanol, AKOS011389363, (1S)-1-(thiophen-2-yl)ethan-1-ol, (1S)-alpha-Methyl-2-thiophenemethanol, AG-B-73730, AG-E-89330, KB-03588, FT-0638737, 2-Thiophenemethanol, |A-methyl-, (alphaS)-, EN300-67021, 2-Thiophenemethanol, A'A|AfA-methyl-, (S)-(-)- (8CI);(S)-1-(2-Thienyl)ethanol;(alphaS)-A'A|AfA-Methyl-2-thiophenemethanol;2-Thiophenemethanol,A'A|AfA-methyl-, (S)-;

Molecular Formula: C6H8OSMolecular Weight: 128.192120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WUNFIVTVJXZDDJ-YFKPBYRVSA-N

• (1S,2S)-1,2-Diphenyl-1,2-ethanediamine
IUPAC Name: [(1S,2S)-2-azaniumyl-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 29841-69-8
Synonyms: ZINC00155133

Molecular Formula: C14H18N2+2Molecular Weight: 214.306120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: PONXTPCRRASWKW-KBPBESRZSA-P

• (2-Benzimidazolylthio)acetic acid hydrazide
IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)acetohydrazide | CAS Registry Number: 30065-27-1
Synonyms: Oprea1_175593, Oprea1_717482, ZINC00039853, CID676606, BAS 00631314, A0773/0036143, (1H-Benzoimidazol-2-ylsulfanyl)-acetic acid hydrazide, (1H-Benzoimidazol-2-ylsulfanyl)acetic acid, hydrazide

Molecular Formula: C9H10N4OSMolecular Weight: 222.266900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UIHKXOZJFOTOCE-UHFFFAOYSA-N

• (R)-(+)-Ethylbenzylamine
IUPAC Name: (1R)-1-phenylpropan-1-amine | CAS Registry Number: 3082-64-2
Synonyms: (R)-(+)-1-Phenylpropylamine, (R)-1-phenylpropan-1-amine, (R)-(+)-|A-Ethylbenzylamine, (1R)-1-phenylpropan-1-amine, (R)-(+)-alpha-Ethylbenzylamine, AG-F-02210, (R)-(+)-mEthylbenzylamine, PubChem6026, d-|A-Ethylbenzylamine, AC1NT5XA, (+)-1-Ethylbenzylamine, R(+)-a-ethylbenzylamine, (R)-1-Phenylpropanamine, (+)-1-Phenylpropylamine, (R)-|A-Ethylbenzylamine, SureCN176808, (+)-|A-Phenylpropylamine, (1R)-1-Phenylpropylamine, KSC495G6J, (R)-1-Phenyl-1-propanamine

Molecular Formula: C9H13NMolecular Weight: 135.206220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: AQFLVLHRZFLDDV-SECBINFHSA-N

• 1,2-Benzisoxazol-3-amine
IUPAC Name: 1,2-benzoxazol-3-amine | CAS Registry Number: 36216-80-5
Synonyms: 1,2-benzoxazol-3-amine, Benzo[d]isoxazol-3-ylamine, 1,2-Benzoisoxazol-3-amine, Benzo[d]isoxazol-3-amine, AG-F-26114, benzo[d]isoxazole-3-ylamine, F1935-0009, zlchem 93, ZINC00161908, PubChem14511, AC1MCW8P, SureCN52685, 3-Amino-1,2-benzisoxazole, benzo[d]isoxazol-3-yl-amine, AC1Q538K, AC1Q538L, CTK1C2268, ZLB0082, MolPort-000-144-959, HMS1655N17

Molecular Formula: C7H6N2OMolecular Weight: 134.135340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NLMVYUBGWZWUGB-UHFFFAOYSA-N

• (S)-(+)-Propanediol
IUPAC Name: propane-1,2-diol | CAS Registry Number: 4254-15-3
Synonyms: propylene glycol, 1,2-propanediol, Sirlene, propane-1,2-diol, Trimethyl glycol, Dowfrost, 2-Hydroxypropanol, Methylethyl glycol, Solargard P, 2,3-Propanediol, 1,2-Propylene glycol, Methyl glycol, Monopropylene glycol, propanediol, Methylethylene glycol, Isopropylene glycol, Solar Winter BAN, dl-Propylene glycol, 1,2-dihydroxypropane, alpha-Propyleneglycol

Molecular Formula: C3H8O2Molecular Weight: 76.094420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: DNIAPMSPPWPWGF-UHFFFAOYSA-N

• (+/-)-Methadone-D3
IUPAC Name: 1,1,1-trideuterio-6-(dimethylamino)-4,4-diphenylheptan-3-one | CAS Registry Number: 60263-63-0
Synonyms: DL-Methadone-d3 solution, DL-Methadone-(heptyl-1,1,1-d3) solution, FT-0640678, DL-6-Dimethylamino-4,4-diphenyl-3-heptanone-1,1,1-d3 solution

Molecular Formula: C21H27NOMolecular Weight: 312.463665 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: USSIQXCVUWKGNF-FIBGUPNXSA-N

• (4-Nitrophenyl)piperazin-1-yl-methanone
IUPAC Name: (4-nitrophenyl)-piperazin-1-ylmethanone | CAS Registry Number: 72141-41-4
Synonyms: 1-(4-Nitrobenzoyl)piperazine, (4-nitrophenyl)piperazin-1-yl-methanone, (4-nitrophenyl)(piperazino)methanone, (4-Nitrophenyl)(piperazin-1-yl)methanone, (4-Nitro-phenyl)-piperazin-1-yl-methanone, 4-nitrophenyl piperazinyl ketone, AC1LBYOW, BAS 01375857, Maybridge1_001363, nitrophenylpiperazinomethanone, SureCN2710229, Oprea1_856236, Oprea1_857687, 1-(4-nitrobenzoyl)-piperazine, CHEMBL327793, CTK5D5604, HMS545F21, MolPort-000-157-783, BTB06396, CCG-51542

Molecular Formula: C11H13N3O3Molecular Weight: 235.239220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HIQSQKKHPVVUEJ-UHFFFAOYSA-N

• (E)Ethyl4-(3,4-dimethoxyphenyl)-4-oxo-2-butenoate
IUPAC Name: (E)-4-(3,4-dimethoxyphenyl)-4-oxobut-2-enoic acid | CAS Registry Number: 80937-23-1
Synonyms: EINECS 279-631-0, BRN 3137849, 4-(3,4-Dimethoxyphenyl)-4-oxocrotonic acid, LS-47127, (E)-4-(3,4-Dimethoxyphenyl)-4-oxo-2-butenoic acid, 3-10-00-04602 (Beilstein Handbook Reference), 2-Butenoic acid, 4-(3,4-dimethoxyphenyl)-4-oxo-, (E)-, Acide (E)4-(3,4-dimethoxy-phenyl)-4-oxo-2-butenoique [French]

Molecular Formula: C12H12O5Molecular Weight: 236.220680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: QUWWWXPLUJFEHM-GQCTYLIASA-N

• 2-Methylbenzhydrylchloride
IUPAC Name: 1-[chloro(phenyl)methyl]-2-methylbenzene | CAS Registry Number: 41870-52-4
Synonyms: 2-METHYLBENZHYDRYL CHLORIDE, 2-Methyl benzhydryl chloride, 1-[chloro(phenyl)methyl]-2-methylbenzene, SBB070797, AG-E-08223, 1(-Chlorophenyl-methyl)-2-mehtylbenzene, 1-(Chloro(phenyl)methyl)-2-methylbenzene, AC1Q2EMY, ACMC-1AN31, SureCN10799696, 2-(alpha-Chlorobenzyl)toluene, CTK8B1668, MolPort-002-470-572, Chloro(2-methylphenyl)phenylmethane, ANW-29693, AKOS001261297, 2-(chlorophenylmethyl)-1-methylbenzene, AG-F-48787, MCULE-4606041590, AC-14475

Molecular Formula: C14H13ClMolecular Weight: 216.706020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VTZTUKIBJQCCMO-UHFFFAOYSA-N

• 7-Methoxycoumarin-4-acetic acid
IUPAC Name: 2-(7-methoxy-2-oxochromen-4-yl)acetic acid | CAS Registry Number: 62935-72-2
Synonyms: Oprea1_229870, Oprea1_350851, MLS000676412, 235199_ALDRICH, CHEBI:51666, NSC378137, CID342221, NCI60_003557, SMR000298433, (7-methoxy-2-oxo-2H-chromen-4-yl)acetic acid, ST5319793, 7-Methoxy-2-oxo-2H-1-benzopyran-4-acetic acid, InChI=1/C12H10O5/c1-16-8-2-3-9-7(4-11(13)14)5-12(15)17-10(9)6-8/h2-3,5-6H,4H2,1H3,(H,13,14

Molecular Formula: C12H10O5Molecular Weight: 234.204800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: ZEKAXIFHLIITGV-UHFFFAOYSA-N

• (S)-(+)-Alpha-Methoxy-Alpha-Trifluoromethylphenylacetyl Chloride
IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride | CAS Registry Number: 39637-99-5
Synonyms: Mosher's acid chloride, (R)-(-)-MTPA-Cl, 65363_FLUKA, ZINC02584598, CID3080792, (-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, (R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, Benzeneacetyl chloride, alpha-methoxy-alpha-(trifluoromethyl)-, (R)-, 20445-33-4

Molecular Formula: C10H8ClF3O2Molecular Weight: 252.617530 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: PAORVUMOXXAMPL-VIFPVBQESA-N

• 1,1,2,3,3,4,4-Heptafluoro-1-Butene
IUPAC Name: 1,1,2,3,3,4,4-heptafluorobut-1-ene | CAS Registry Number: 680-54-6
Synonyms: 1,1,2,3,3,4,4-heptafluorobut-1-ene, 1,1,2,3,3,4,4-HEPTAFLUORO-1-BUTENE, AG-G-59358, 1H-Perfluorobut-1-ene, AC1MCP2C, CTK5C7228, MolPort-001-771-331, PC0952, SBB089846, AKOS006228186, KB-09766, FT-0605973, 1,1,2,3,3,4,4-heptakis(fluoranyl)but-1-ene, A835992, I14-29158

Molecular Formula: C4HF7Molecular Weight: 182.039562 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: NUPBXTZOBYEVIR-UHFFFAOYSA-N

• 2-(1,1,2,2-Tetrafluoroethoxymethyl)Oxirane
IUPAC Name: 2-(1,1,2,2-tetrafluoroethoxymethyl)oxirane | CAS Registry Number: 85567-21-1
Synonyms: 445428_ALDRICH, 2H-Perfluoroethyl glycidyl ether, EINECS 287-734-7, ZINC02584570, CID2776649, Glycidyl 1,1,2,2-tetrafluoroethyl ether, ((1,1,2,2-Tetrafluoroethoxy)methyl)oxirane

Molecular Formula: C5H6F4O2Molecular Weight: 174.093553 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: HFNPKDDYCOMYLN-UHFFFAOYSA-N

• 1-Hydroxymethyl-5,5-Dimethylhydantoin
IUPAC Name: 1-(hydroxymethyl)-5,5-dimethylimidazolidine-2,4-dione | CAS Registry Number: 116-25-6
Synonyms: MDM Hydantoin, GlycoServe, MDMH, MDM Hydantoin (VAN), Monomethylol dimethyl hydantoin, Mono-methyloldimethylhydantoin, NSC 9185, EINECS 204-132-1, NSC9185, 1-Monomethylol-5,5-dimethylhydantoin, 1-(Hydroxymethyl)-5,5-dimethylhydantoin, 1-Hydroxymethyl-5,5-dimethylhydantoin, EPA Pesticide Chemical Code 121301, CID67000, Hydroxymethyl-5,5-dimethylhydantoin, ZINC00156245, Hydantoin, 1-(hydroxymethyl)-5,5-dimethyl-, 1-(Hydroxymethyl)-5,5-dimethyl hydantoin, NCGC00164225-01, LS-79198

Molecular Formula: C6H10N2O3Molecular Weight: 158.155200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SIQZJFKTROUNPI-UHFFFAOYSA-N

• (+)-Aromadendrene
IUPAC Name: (1aR,4aS,7R,7aS,7bS)-1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene | CAS Registry Number: 489-39-4
Synonyms: (+)-AROMADENDRENE

Molecular Formula: C15H24Molecular Weight: 204.351060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ITYNGVSTWVVPIC-XGFWRYKXSA-N

• 1,2-Diiodoethane
IUPAC Name: 1,2-diiodoethane | CAS Registry Number: 624-73-7
Synonyms: Diiodoethane, Ethylene iodide, Ethylene diiodide, Ethane, 1,2-diiodo-, 1,2-DIIODOETHANE, D122807_ALDRICH, CID12224, EINECS 210-859-5, OR2622, TL8004160, InChI=1/C2H4I2/c3-1-2-4/h1-2H

Molecular Formula: C2H4I2Molecular Weight: 281.862100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: GBBZLMLLFVFKJM-UHFFFAOYSA-N

• (+)-Cuparene
IUPAC Name: 1-methyl-4-[(1R)-1,2,2-trimethylcyclopentyl]benzene | CAS Registry Number: 16982-00-6
Synonyms: Cuparene, ()-Cuparene, 28255_ALDRICH, 28255_FLUKA, CID86895, EINECS 241-061-5, LMPR0103140001, (R)-1-(p-Tolyl)-1,2,2-trimethylcyclopentane, (R)-(+)-p-(1,2,2-Trimethylcyclopentyl)toluene, Benzene, 1-methyl-4-(1,2,2-trimethylcyclopentyl)-, (theta)-

Molecular Formula: C15H22Molecular Weight: 202.335180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SLKPBCXNFNIJSV-HNNXBMFYSA-N

• 1,2-Difluoro-4,5-Dimethoxybenzene
IUPAC Name: 1,2-difluoro-4,5-dimethoxybenzene | CAS Registry Number: 203059-80-7
Synonyms: 4,5-Difluoroveratrole, 369128_ALDRICH, 1,2-Difluoro-4,5-dimethoxybenzene, MolPort-001-777-757, ZINC00389790, CID853175, D3626, LT01148411, InChI=1/C8H8F2O2/c1-11-7-3-5(9)6(10)4-8(7)12-2/h3-4H,1-2H

Molecular Formula: C8H8F2O2Molecular Weight: 174.144726 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WWAOVLXLTJXDGS-UHFFFAOYSA-N

• (R)-Bicalutamide
IUPAC Name: (2R)-N-[4-cyano-3-(trifluoromethyl)phenyl]-2-hydroxy-2-methyl-3-(2,3,5,6-tetradeuterio-4-fluorophenyl)sulfonylpropanamide | CAS Registry Number: 113299-40-4
Synonyms: (R)-Bicalutamide-d4, (R)-Casodex, CTK8F2035, AG-A-07557

Molecular Formula: C18H14F4N2O4SMolecular Weight: 434.398020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: LKJPYSCBVHEWIU-FTFUYGBWSA-N

• 6-Ethoxy-2,2,4-Trimethyl-1,2-Dihydroquinoline
IUPAC Name: 6-ethoxy-2,2,4-trimethyl-1H-quinoline | CAS Registry Number: 91-53-2
Synonyms: ethoxyquin, Santoquin, Ethoxyquine, Santoquine, Niflex, Antioxidant EC, Santoflex A, Santoflex AW, Stop-Scald, Dawe's nutrigard, Nix-Scald, Nocrack AW, Quinol ED, Aries Antox, Niflex D, Antage AW, Nocrac AW, Permanax 103, Alterungsschutzmittel EC, Ethoxyquin [ISO]

Molecular Formula: C14H19NOMolecular Weight: 217.306760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DECIPOUIJURFOJ-UHFFFAOYSA-N

• (R)-4-Boc-Piperazine-2-carboxyl-t-butylamide
IUPAC Name: tert-butyl (3R)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate | CAS Registry Number: 171866-36-7
Synonyms: SBB027352, tert-butyl (3R)-3-(tert-butylcarbamoyl)piperazine-1-carboxylate, tert-butyl (3R)-3-[N-(tert-butyl)carbamoyl]piperazinecarboxylate, N-tert-Butyl-4-(tert-butoxycarbonyl)-(S)-2-piperazine carboxamide, AC1MC11I, CB-203, ZINC54976511, AKOS022181183, AC-6697, AN-9734, VP70054, AK-60121, AJ-112596, FT-0643645, ST50826098, (R)-4-BOC-PIPERAZINE-2-CARBOXYL-T-BUTYLAMIDE, I14-38082, (R)-tert-Butyl 3-(tert-butylcarbamoyl)piperazine-1-carboxylate, (R)-(-)-2-(tert-Butylcarboxyamide)-4-tert-butoxycarbonylpiperazine

Molecular Formula: C14H27N3O3Molecular Weight: 285.382480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NASIOHFAYPRIAC-SNVBAGLBSA-N

• (D)-Pipecolic acid
IUPAC Name: piperidine-2-carboxylic acid | CAS Registry Number: 1723-00-8
Synonyms: Pipecolic acid, Homoproline, Pipecolinic acid, pipecolate, Dihydrobaikiane, l-Pipecolic acid, L-pipecolate, Piperolinic acid, homopipecolic acid, Hexahydropicolinic acid, Pipecolic acid, L-, L-Pipecolinic acid, 2-PIPERIDINECARBOXYLIC ACID, DL-Pipecolinic acid, .alpha.-Pipecolinic acid, Acide pipecolique [French], Pipecolic acid free base, Pipecolic acid, L-(-)-, Pipecolic acid, (S)-(-)-, pipecolic acid, ion (1-)

Molecular Formula: C6H11NO2Molecular Weight: 129.157040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HXEACLLIILLPRG-UHFFFAOYSA-N

• (3-Chloropyridazin-6-yl)hydrazine
IUPAC Name: (6-chloropyridazin-3-yl)hydrazine | CAS Registry Number: 17284-97-8
Synonyms: 3-Chloro-6-hydrazinopyridazine, Abc 907, Abc-907, MLS001004123, 632619_ALDRICH, 3-Chloro-6-hydrazino-pyridazine, 6-Chloro-3-hydrazino-pyridazine, NSC367616, ZINC01225177, SMR000377809, 3(2H)-Pyridazinone, 6-chloro-, hydrazone, ST5211288, TL8001365, InChI=1/C4H5ClN4/c5-3-1-2-4(7-6)9-8-3/h1-2H,6H2,(H,7,9

Molecular Formula: C4H5ClN4Molecular Weight: 144.562300 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FXYQRYGWWZKUFV-UHFFFAOYSA-N

• (4-Chlorobenzenesulphonyl)acetontrile
IUPAC Name: 2-(4-chlorophenyl)sulfonylacetonitrile | CAS Registry Number: 1851-09-8
Synonyms: ZINC00153541, CID735829, SBB016387, p-CHLOROPHENYLSULFONYLACETONITRILE, SR-01000632647-1

Molecular Formula: C8H6ClNO2SMolecular Weight: 215.656740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HAQGVGPNKGGSMK-UHFFFAOYSA-N

• (+/-)-2-(6-Methoxy-2-naphthyl)propionic acid
IUPAC Name: 2-(6-methoxynaphthalen-2-yl)propanoic acid | CAS Registry Number: 23981-80-8
Synonyms: NAPROXEN, Naprosyn, Naprosyn (TN), Prestwick3_000045, Oprea1_018821, BSPBio_000169, MLS002154184, Naproxen (JP15/USP/INN), BPBio1_000187, CID1302, EINECS 245-969-2, EINECS 247-485-7, DB00788, 2-(6-Methoxy-2-naphthyl)propanoic acid, 2-(6-Methoxy-2-naphthyl)propionic acid, NCGC00094733-01, NCGC00094733-02, NCGC00094733-03, SMR001233475, ST024763

Molecular Formula: C14H14O3Molecular Weight: 230.259160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CMWTZPSULFXXJA-UHFFFAOYSA-N

• 4-Bromobenzhydrol
IUPAC Name: (4-bromophenyl)-phenylmethanol | CAS Registry Number: 29334-16-5
Synonyms: p-Bromobenzhydrol, Benzhydrol, 4-bromo-, p-Bromobenzhydryl alcohol, NCIOpen2_006363, NSC89817, EINECS 249-568-3, Benzenemethanol, 4-bromo-.alpha.-phenyl-, ST5409727

Molecular Formula: C13H11BrOMolecular Weight: 263.129840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WTIWDBNPPSHSCB-UHFFFAOYSA-N


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