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Molekula Limited

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Contact: Kristan Banks
Web: http://www.molekula.com
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Address: Lingfield Way, Darlington, Durham DL1 4XX, United Kingdom
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Profile: Molekula Limited specializes in offering research chemicals and biochemicals. Our active pharmaceutical ingredients include acetyllovastatin, acetylsimvastatin, acyclovir and albendazole. Our fluorinated products are aluminum fluoride trihydrate, 4-aminobenzotrifluoride, 3-amino-5-bromobenzotrifluoride and aluminum trifluoromethanesulfonate. Our piperazines include N-carbethoxy piperazine, 1-cyclohexylpiperazine, 1-boc-piperazine and 1-benzylpiperazine.

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• (S)-(+)-sec-Butylamine
IUPAC Name: butan-2-amine | CAS Registry Number: 513-49-5
Synonyms: 2-Butanamine, Deccotane, Butafume, Frucote, Tutane, SEC-BUTYLAMINE, 2-Aminobutane, 2-Butylamine, 1-Methylpropanamine, 1-Methylpropylamine, 2-Aminobutane base, butan-2-amine, S-2-Butylamine, Butylamine [ISO], sec-Butylamine, (S)-, (S)-sec-Butylamine, (S)-2-Aminobutane, (+)-2-Butylamine, (RS)-sec-Butylamine, Caswell No. 125

Molecular Formula: C4H11NMolecular Weight: 73.136840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BHRZNVHARXXAHW-UHFFFAOYSA-N

• 4-Sulfonamide Phenyl Hydrazine HCl
IUPAC Name: 4-hydrazinylbenzenesulfonamide;hydrochloride | CAS Registry Number: 27918-19-0
Synonyms: 17852-52-7, 4-hydrazinobenzene-1-sulfonamide hydrochloride, 4-hydrazinylbenzenesulfonamide Hydrochloride, 4-Hydrazinobenzenesulfonamide Hydrochloride, 4-sulfonamidephenylhydrazine hcl, 4-Aminosulfonylphenylhydrazine hydrochloride, 4-Sulfonamidophenylhydrazine hydrochloride, 4-Hydrazino-benzenesulfonamide hydrochloride, 4-hydrazinobenzene-1-sulfonamide hcl, 4-sulfonamide-phenylhydrazine hydrochloride, PubChem6410, PubChem19838, AC1MDRE2, AC1Q3DGK, ACMC-1BON1, SureCN981171, KSC174G7L, CTK0H4375, 4-hydrazinobenzenesulphonamide hcl, 4-hydrazinobenzene sulfonamide hcl

Molecular Formula: C6H10ClN3O2SMolecular Weight: 223.680500 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: IKEURONJLPUALY-UHFFFAOYSA-N

• (S)-2-Hydroxybutyric Acid
IUPAC Name: (2S)-2-hydroxybutanoic acid | CAS Registry Number: 3347-90-8
Synonyms: (S)-2-Hydroxybutyric acid, (S)-2-hydroxybutanoic acid, (2S)-2-hydroxybutanoic acid, L-2-hydroxybutyric acid, 2-Hydroxybutyrate, S-2-hydroxybutyric acid, PubChem8265, 2S-Hydroxybutanoic acid, 2S-hydroxy-butanoic acid, L-2-hydroxybutanoic acid, (S)-2-Hydroxybutyricacid, L-alpha-hydroxybutyric acid, AC1L9A2S, L-alpha-hydroxybutanoic acid, 54918_FLUKA, CHEBI:50613, CTK4H0642, MolPort-003-936-471, Butanoic acid,2-hydroxy-, (2S)-, ANW-73908

Molecular Formula: C4H8O3Molecular Weight: 104.104520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AFENDNXGAFYKQO-VKHMYHEASA-N

• (1R,2R)-2-Aminocyclohexanol
IUPAC Name: (1R,2R)-2-aminocyclohexan-1-ol | CAS Registry Number: 931-16-8
Synonyms: (1R,2R)-2-aminocyclohexan-1-ol, (1R,2R)-2-Aminocyclohexanol hydrochloride, trans-2-Aminocyclohexanol, trans-2-Amino-cyclohexanol, 13374-31-7, 6982-39-4, TRANS ACL, AC1LEGMT, PubChem19553, SureCN213812, (1R,2R)-2-aminocylohexanol, CTK8B4284, MolPort-006-170-470, (1R,2R)-2-amino-1-cyclohexanol, ACT06723, (1R,2R)-2-azanylcyclohexan-1-ol, ANW-44600, AR-1L8229, SBB062688, AKOS015854171

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PQMCFTMVQORYJC-PHDIDXHHSA-N

• (2r)-1-Acetyl-2,3-Dihydro-1h-Indole-2-Carboxylic Acid
IUPAC Name: (2R)-1-acetyl-2,3-dihydroindole-2-carboxylic acid | CAS Registry Number: 103476-80-8
Synonyms: (R)-1-Acetylindole-2-carboxylic acid, (R)-1-ACETYLINDOLINE-2-CARBOXYLIC ACID, (R)-1-Acetylindolin-2-carboxylic acid, SureCN2824809, 1H-Indole-2-carboxylicacid, 1-acetyl-2,3-dihydro-, (2R)-, CTK0H2482, AB16686, AG-D-14382, AC-12596, AK-55288, (2R)-1-ACETYL-2,3-DIHYDRO-1H-INDOLE-2-CARBOXYLIC ACID, 1H-Indole-2-carboxylicacid, 1-acetyl-2,3-dihydro-, (R)-; (R)-1-Acetylindoline-2-carboxylic acid

Molecular Formula: C11H11NO3Molecular Weight: 205.209940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OGMIMMRKTFZDKW-SNVBAGLBSA-N

• (S)-2-Chloropropionic acid
IUPAC Name: (2S)-2-chloropropanoic acid | CAS Registry Number: 29617-66-1
Synonyms: (2S)-Chloropropanoic acid, L-2-Chloropropanoic acid, L-2-Chloropropionic acid, alpha-L-Chloropropionic acid, (S)-2-Chloropropanoic acid, 2S-chloropropanoic acid, 2(S)-Chloropropionic acid, beta-Chloropropionic acid, 2(S)-Chloropropionic ac, Propanoic acid, 2-chloro-, L-alpha-Chloropropionic acid, (-)-2-Chloropropanoic acid, (-)-2-Chloropropionic acid, 2-CHLOROPROPANOIC ACID, Propanoic acid, 2-chloro-, (S)-, Propionic acid, 2-chloro-, L-, 306797_ALDRICH, LMFA01090032, Propionic acid, 2-chloro-, L- (8CI), SB 01780

Molecular Formula: C3H5ClO2Molecular Weight: 108.523600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GAWAYYRQGQZKCR-REOHCLBHSA-N

• (9-Anthryl)methacrylate
IUPAC Name: anthracen-9-ylmethyl 2-methylprop-2-enoate | CAS Registry Number: 31645-35-9
Synonyms: 9-Anthracenylmethyl methacrylate, Anthracen-9-ylmethyl 2-methylprop-2-enoate, Anthracen-9-ylmethyl methacrylate, ACMC-1ADNY, AC1MUI1V, 9-Methacryloyloxyanthracene, 578207_ALDRICH, 579017_ALDRICH, MolPort-000-005-336, RJC 02811, SBB067062, ZINC02568170, AKOS015837648, AK114361, KB-250669, FT-0604853, 2-Methyl-2-propenoic Acid 9-Anthracenyl Ester, A820940, 2-methyl-2-propenoic acid 9-anthracenylmethyl ester, I14-0927

Molecular Formula: C19H16O2Molecular Weight: 276.329140 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MJYSISMEPNOHEG-UHFFFAOYSA-N

• 1-(4-Bromophenyl)-2-hydroxyethan-1-one
IUPAC Name: 1-(4-bromophenyl)-2-hydroxyethanone | CAS Registry Number: 3343-45-1
Synonyms: 1-(4-bromophenyl)-2-hydroxyethanone, 1-(4-bromophenyl)-2-hydroxyethan-1-one, CHEMBL1801618, SBB068790, 1-(4-Bromophenyl)-2-hydroxyethane-1-one, ZINC00167257, zlchem 616, AC1LAUIQ, bromophenylhydroxyethanone, SureCN55916, p-Bromo-a-hydroxy acetophenone, CTK4H0583, ZLD0066, MolPort-000-146-992, ACT05833, ANW-55081, AKOS005070623, 1-(4-bromophenyl)-2-hydroxy-ethanone, AG-F-12755, MCULE-5747207409

Molecular Formula: C8H7BrO2Molecular Weight: 215.043980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FGROGLJVXNYNQC-UHFFFAOYSA-N

• 1,3-cyclohexanedicarboxylic
IUPAC Name: cyclohexane-1,3-dicarboxylic acid | CAS Registry Number: 3971-31-1
Synonyms: 375438_ALDRICH, 1,3-Cyclohexanedicarboxylic acid, cis-Cyclohexane-1,3-dicarboxylic acid, CID107205, STK286096, 1,3-Cyclohexanedicarboxylic acid, mixture of cis and trans, 2305-31-9

Molecular Formula: C8H12O4Molecular Weight: 172.178480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XBZSBBLNHFMTEB-UHFFFAOYSA-N

• (S)-4-Amino-2-hydroxybutyric acid
IUPAC Name: (2S)-4-azaniumyl-2-hydroxybutanoate | CAS Registry Number: 40371-51-5
Synonyms: ZINC02019611, CID6999098

Molecular Formula: C4H9NO3Molecular Weight: 119.119160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IVUOMFWNDGNLBJ-VKHMYHEASA-N

• (R)-1-Tosyloxy-2,3-propanediol
IUPAC Name: [(2R)-2,3-dihydroxypropyl] 4-methylbenzenesulfonate | CAS Registry Number: 41274-09-3
Synonyms: (R)-Glycerol 1-(p-toluenesulfonate), (R)-1-TOSYLOXY-2,3-PROPANEDIOL, PubChem5792, (R)-1-Tosyloxyglycerol, CTK4I4543, ZINC02562402, (R)-3-(Tosyloxy)-1,2-propanediol, AKOS015897553, AG-F-46904, AC-16743, FT-0605134, FT-0605306, FT-0675325, ST51053583, (R)-3-(p-Toluenesulfonyloxy)-1,2-propanediol, (R)-1,2,3-Propanetriol 4-methylbenzenesulfonate, I09-0945, 1,2,3-Propanetriol,1-(4-methylbenzenesulfonate), (2R)-, 1,2,3-Propanetriol,1-(4-methylbenzenesulfonate), (R)-;(R)-1,2,3-Propanetriol4-methylbenzenesulfonate;(R)-1-(Tosyloxy)-2,3-propanediol;(R)-1-Tosyloxyglycerol;(R)-3-(Tosyloxy)-1,2-propanediol;D-3-Tosylglycerol;

Molecular Formula: C10H14O5SMolecular Weight: 246.280160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: DFQNMODTAFTGHS-SECBINFHSA-N

• (S)-(+)-2-Butanol
IUPAC Name: butan-2-ol | CAS Registry Number: 4221-99-2
Synonyms: 2-Butanol, 2-Hydroxybutane, sec-Butanol, Butylene hydrate, Butan-2-ol, SEC-BUTYL ALCOHOL, 2-Butyl alcohol, s-Butyl alcohol, Methylethylcarbinol, s-Butanol, Methyl ethyl carbinol, s-Butylalkohol, 1-Methyl-1-propanol, Butanol-2, 1-Methylpropyl alcohol, 1-Methyl propanol, Ethyl methyl carbinol, Ethylmethyl carbinol, Methylethyl carbinol, Butanol secondaire

Molecular Formula: C4H10OMolecular Weight: 74.121600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BTANRVKWQNVYAZ-UHFFFAOYSA-N

• (+)-((Camphoryl)sulfonyl)oxaziridine
Synonyms: ZINC04202596

Molecular Formula: C10H15NO3SMolecular Weight: 229.296000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GBBJBUGPGFNISJ-YDQXZVTASA-N

• (1R)-(+)-2,10-Camphorsultam
Synonyms: D-2,10-Camphorsultam, (-)-10,2-Camphorsultam, (2S)-Bornane-10,2-sultam, MLS000547527, CID145454, ZINC00404778, SMR000113261, 10,10-dimethyl-3-thia-4-azatricyclo[5.2.1.0~1,5~]decane3,3-dioxide, 4-Aza-5-thiatricyclo[5.2.1.0(3,7)]decane-5,5-dioxide, (7S)-10,10-dimethyl-

Molecular Formula: C10H17NO2SMolecular Weight: 215.312480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DPJYJNYYDJOJNO-UHFFFAOYSA-N

• (R)-Piperazine-2-carboxylic acid dihydrochloride
IUPAC Name: (2R)-piperazine-2-carboxylic acid;dihydrochloride | CAS Registry Number: 126330-90-3
Synonyms: (R)-2-Piperazinecarboxylic acid dihydrochloride, (R)-Piperazine-2-carboxylic acid 2HCl, (R)-(+)-2-Piperazinecarboxylic acid dihydrochloride, (R)-(+)-Piperazine-2-carboxylic acid dihydrochloride, 2-(R)-Piperazine carboxylic acid 2HCl, (R)-piperazine-2-carboxylicaciddihydrochloride, SureCN283015, KSC496A5H, Jsp001680, 67176_FLUKA, CTK3J6053, MolPort-000-005-914, BH788, ACN-S002924, ACT02151, ANW-18926, FC0187, AKOS015845424, AC-1211, OR15637

Molecular Formula: C5H12Cl2N2O2Molecular Weight: 203.066980 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 4

InChIKey: WNSDZBQLMGKPQS-RZFWHQLPSA-N

• (-)-Actinonin
IUPAC Name: (2R)-N'-hydroxy-N-[(2S)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-pentylbutanediamide | CAS Registry Number: 13434-13-4
Synonyms: actinonin, Actinonine, Spectrum2_000628, Spectrum3_000680, Spectrum4_001932, Spectrum5_000728, Lopac0_000010, BSPBio_002379, KBioGR_002305, DivK1c_001024, SPBio_000596, KBio1_001024, KBio3_001599, NINDS_001024, AIDS110792, C19H35N3O5, AIDS-110792, CID443600, CPD0-1358, IDI1_001024

Molecular Formula: C19H35N3O5Molecular Weight: 385.498300 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: XJLATMLVMSFZBN-VYDXJSESSA-N

• 2-Hydroxyimino-2-(2-pyridylsulfonyl)acetonitrile
IUPAC Name: 2-hydroxyimino-2-pyridin-2-ylsulfonylacetonitrile | CAS Registry Number: 175137-69-6
Synonyms: 2-hydroxyimino-2-(2-pyridylsulfonyl)acetonitrile, AC1MCTD4, Maybridge1_004626, CTK4D5365, AG-E-25004, KB-68861, 2-hydroxyimino-2-(2-pyridinylsulfonyl)acetonitrile, 2-hydroxyimino-2-(2-pyridylsulphonyl)acetonitrile, 2-hydroxyimino-2-pyridin-2-ylsulfonylacetonitrile, A811801, 2-hydroxyimino-2-pyridin-2-ylsulfonyl-ethanenitrile, 2-HYDROXYIMINO-2-(PYRIDIN-2-YLSULFONYL)ACETONITRILE

Molecular Formula: C7H5N3O3SMolecular Weight: 211.197900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: YGMWCSZEJYENBM-UHFFFAOYSA-N

• (1S,2S)-Cyclohexane-1,2-diamine
IUPAC Name: cyclohexane-1,2-diamine | CAS Registry Number: 21436-03-3
Synonyms: 1,2-Cyclohexanediamine, 1,2-Cylohexanediamine, cis-1,2-Cyclohexanediamine, 1,2-DIAMINOCYCLOHEXANE, cis-1,2-Cyclohexandiamine, Cyclohex-1,2-ylenediamine, trans-1,2-Cyclohexanediamine, cyclohexane-1,2-diamine, trans-1,2-Cyclohexaneiamine, HSDB 5748, 132551_ALDRICH, 293962_ALDRICH, (+)-S,S-1,2-Diaminocyclohexane, EINECS 211-776-7, CID4610, (1S,2S)-(+)-1,2-Diaminocyclohexane, (-)-R,R-1,2-Diaminocyclohexane, BRN 0506142, NSC362640, NSC362641

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSJXIUAHEKJCMH-UHFFFAOYSA-N

• (R)-(+)-alpha, alpha-Diphenyl-2-pyrrolidinemethanol
IUPAC Name: di(phenyl)-[(2R)-pyrrolidin-1-ium-2-yl]methanol | CAS Registry Number: 22348-32-9
Synonyms: ZINC03632771

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

InChIKey: OGCGXUGBDJGFFY-MRXNPFEDSA-O

• 3-Thienylmalonic acid
IUPAC Name: 2-thiophen-3-ylpropanedioic acid | CAS Registry Number: 21080-92-2
Synonyms: 3-Thienylpropanedioic acid, 3-Thiophenemalonic acid, (3-Thienyl)malonic acid, Thiophene-3-malonic acid, Propanedioic acid, 3-thienyl-, 215317_ALDRICH, alpha-Carboxythiophene-3-acetic acid, EINECS 244-198-9, ST5308440, TL8001752

Molecular Formula: C7H6O4SMolecular Weight: 186.185140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GCOOGCQWQFRJEK-UHFFFAOYSA-N

• (1R,2R)-1,2-Diphenyl-1,2-ethanediamine
IUPAC Name: [(1R,2R)-2-azaniumyl-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 35132-20-8
Synonyms: ZINC00155131

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

InChIKey: PONXTPCRRASWKW-ZIAGYGMSSA-P

• (R)-5-Methyldihydrofuran-2-one
IUPAC Name: (5R)-5-methyloxolan-2-one | CAS Registry Number: 58917-25-2
Synonyms: (R)-gamma-Valerolactone, (5R)-5-methyloxolan-2-one, (R)-Dihydro-5-methyl-2(3H)-furanone, (R)- feminineValerolactone, (R)-gamma-Methyl-gamma-butyrolactone, PubChem6865, (R)-|A-Valerolactone, (+)-gamma-valerolactone, SureCN265674, AC1LD5S1, 43948_ALDRICH, (+)-(R)-gamma-valerolactone, (R)-(+)-gamma-valerolactone, 43948_FLUKA, CHEBI:48570, MolPort-003-932-892, ZINC03860818, (5R)-5-methyldihydrofuran-2(3H)-one, (+)-(R)-5-methyl-2-oxotetrahydrofuran, I14-17183

Molecular Formula: C5H8O2Molecular Weight: 100.115820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GAEKPEKOJKCEMS-SCSAIBSYSA-N

• (S)-Methyl glycidyl ether
IUPAC Name: (2S)-2-(methoxymethyl)oxirane | CAS Registry Number: 64491-68-5
Synonyms: 454699_ALDRICH, (S)-()-Glycidyl methyl ether, (S)-()-Methyl glycidyl ether, 50025_FLUKA, (S)-()-2-(Methoxymethyl)oxirane, ZINC01556604

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LKMJVFRMDSNFRT-SCSAIBSYSA-N

• 5-Amino-4-cyano-3-cyanomethyl-1-phenylpyrazole
IUPAC Name: 5-amino-3-(cyanomethyl)-1-phenylpyrazole-4-carbonitrile | CAS Registry Number: 7152-40-1
Synonyms: Maybridge1_007079, MLS000570505, EINECS 230-496-6, NSC 22494, NSC22494, BRN 0217441, ZINC00096718, WLN: T5NNJ AR& C1CN DCN EZ, 1-Phenyl-3-cyanomethyl-4-cyano-5-aminopyrazole, 5-Amino-4-cyano-1-phenyl-3-pyrazoleacetonitrile, BAS 00282075, SMR000186932, LS-128075, 4-Pyrazolecarbonitrile, 5-amino-3-cyanomethyl-1-phenyl-, 1H-Pyrazole-3-acetonitrile, 5-amino-4-cyano-1-phenyl-, 5-25-17-00107 (Beilstein Handbook Reference), A3301/0140282, 5-Amino-4-cyano-1-phenyl-1H-pyrazole-3-acetonitrile, 5-Amino-3-cyanomethyl-1-phenyl-1H-pyrazole-4-carbonitrile, 1H-Pyrazole-3-acetonitrile, 5-amino-4-cyano-1-phenyl- (9CI)

Molecular Formula: C12H9N5Molecular Weight: 223.233360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: GUHSDYKJSKLWJF-UHFFFAOYSA-N

• 2-Hydroxyimino-2-(phenylsulfonyl)acetonitrile
IUPAC Name: (2E)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile | CAS Registry Number: 74755-16-1
Synonyms: AG-G-97499, HMS554M04, MolPort-002-905-484, CCG-54428, KM01354, (benzenesulfonyl)methanecarbonimidoyl cyanide, FT-0612612, A838219, (2E)-2-(benzenesulfonyl)-2-hydroxyiminoacetonitrile, (2E)-2-hydroxyimino-2-(phenylsulfonyl)ethanenitrile, SR-01000643525-1

Molecular Formula: C8H6N2O3SMolecular Weight: 210.209840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: WUECNENOORYKIB-CSKARUKUSA-N

• (R)-(-)-2-Methylpiperazine
IUPAC Name: (2R)-2-methylpiperazine | CAS Registry Number: 75336-86-6
Synonyms: R-2-Methylpiperazine, 397164_ALDRICH, NSC5277, 2-METHYL PIPERAZINE, ANHYDROUS, CID7330434, (R)-(−)-2-Methylpiperazine, FS011294, TL8005161, InChI=1/C5H12N2/c1-5-4-6-2-3-7-5/h5-7H,2-4H2,1H, 109-07-9

Molecular Formula: C5H12N2Molecular Weight: 100.162180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JOMNTHCQHJPVAZ-RXMQYKEDSA-N

• (S)-(+)-2-Phenylpropionic acid
IUPAC Name: 2-phenylpropanoic acid | CAS Registry Number: 7782-24-3
Synonyms: Hydratropic acid, 2-Phenylpropionic acid, Hydratropasaeure, 2-Phenylpropanoic acid, ()-Hydratropic acid, (+-)-Hydratropasaeure, (+-)-hydratropic acid, alpha-Phenylpropioic acid, alpha-Methylphenylacetic acid, alpha-Methylbenzeneacetic acid, ()-2-Phenylpropionic acid, .alpha.-Phenylpropionic acid, P31701_ALDRICH, ALPHA-PHENYLPROPIONIC ACID, hydratropic acid, (R)-isomer, hydratropic acid, (S)-isomer, Benzeneacetic acid, .alpha.-methyl-, .alpha.-Methylphenylacetic acid, hydratropic acid, (+-)-isomer, .alpha.-Methylbenzeneacetic acid

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YPGCWEMNNLXISK-UHFFFAOYSA-N

• (R)-2-Amino-1,2-diphenyl-1-propanol
IUPAC Name: (2R)-2-amino-1,1-diphenylpropan-1-ol | CAS Registry Number: 78603-93-7
Synonyms: (R)-(+)-2-Amino-1,1-diphenyl-1-propanol, (R)-2-amino-1,1-diphenylpropan-1-ol, AK-36392, (R)-2-Amino-1,1-Diphenyl-1-Propanol, PubChem6394, AC1LE85P, SCHEMBL1153634, FMBMNSFOFOAIMZ-GFCCVEGCSA-N, AC1Q2981, ZINC4973914, ZX-RL004836, 2311AC, MFCD02677967, SBB066180, AKOS015895581, VC30017, (R)-1,1-Diphenyl-2-amino-1-propanol, (2R)-2-Amino-1,1-diphenyl-1-propanol, (2R)-2-amino-1,1-diphenylpropan-1-ol, OR055482

Molecular Formula: C15H17NOMolecular Weight: 227.307 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FMBMNSFOFOAIMZ-GFCCVEGCSA-N

• (S)-3-Hydroxytetrahydrofuran
IUPAC Name: (3S)-oxolan-3-ol | CAS Registry Number: 86087-23-2
Synonyms: (S)-(+)-3-Hydroxytetrahydrofuran, (3S)-oxolan-3-ol, (S)-(+)-tetrahyro-3-furanol, (S)-(+)-Tetrahydro-3-furanol, (S)-TETRAHYDRO-3-FURANOL, SBB062959, AG-H-17260, (S)-(+)-3-Hydoxy tetahydro tetrahydro furan, (S)-Tetrahydrofuran-3-ol, 84976-47-6, (3S)oxolan-3-ol, AC1MBYEJ, PubChem11341, PubChem16209, S-3-Hydroxytetrahydrofuran, SureCN158873, AC1Q59TD, KSC447S9N, 296686_ALDRICH, 3S-HYDROXYTETRAHYDROFURAN

Molecular Formula: C4H8O2Molecular Weight: 88.105120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XDPCNPCKDGQBAN-BYPYZUCNSA-N

• (1r,2r)-(-)-n-p-tosyl-1,2-diphenylethylenediamine
IUPAC Name: [(1R,2R)-2-[(4-methylphenyl)sulfonylamino]-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 144222-34-4
Synonyms: ZINC04204432, ZINC04284369, CID7168148

Molecular Formula: C21H23N2O2S+Molecular Weight: 367.484520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: UOPFIWYXBIHPIP-NHCUHLMSSA-O

• 4-Oxo-Myrtenylpivalate
IUPAC Name: [(1S,5R)-6,6-dimethyl-4-oxo-2-bicyclo[3.1.1]hept-2-enyl]methyl 2,2-dimethylpropanoate | CAS Registry Number: 113473-32-8
Synonyms: SCHEMBL18944058, ZINC57108, NJIUSKQTOGHXSZ-MNOVXSKESA-N, (1S)-(+)-4-OXOMYRTENYL PIVALATE, 97, 1056567-04-4

Molecular Formula: C15H22O3Molecular Weight: 250.338 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NJIUSKQTOGHXSZ-MNOVXSKESA-N

• (R)-Tetrahydrofurfurylamine
IUPAC Name: [(2R)-oxolan-2-yl]methanamine | CAS Registry Number: 7202-43-9
Synonyms: (R)-(-)-Tetrahydrofurfurylamine, (R)-2-(Aminomethyl)tetrahydrofuran, (R)-(tetrahydrofuran-2-yl)methanamine, PubChem7001, R-Tetrahydrofurfurylamine, AC1MC0ET, SureCN226121, (R)-tetrahydrofurfurylamine, Ambcb4036792, (2R)-oxolan-2-ylmethanamine, 412937_ALDRICH, AC1Q50F4, [(2R)-oxolan-2-yl]methanamine, MolPort-001-791-947, ANW-36143, RW3007, AKOS015836399, AM81808, LS30245, RP18742

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YNOGYQAEJGADFJ-RXMQYKEDSA-N

• (R)-(+)-1,2-Epoxybutane
IUPAC Name: (2R)-2-ethyloxirane | CAS Registry Number: 3760-95-0
Synonyms: (R)-1,2-Epoxybutane, (2R)-2-ethyloxirane, (2R)-Ethyloxirane, PubChem14098, (R)-(+)-Ethyloxirane, (R)-(+)-Butylene Oxide, (R)-(+)-Ethylethylene Oxide, 532355_ALDRICH, CTK3J4902, (2R)-(+)-1,2-Epoxybutane, MolPort-003-936-043, ZINC02013002, AG-F-32291, LS30243, OR42174, (2R)-(+)-3-Methyl-1,2-propenoxide, KB-63120, B3832, A801527, I14-8455

Molecular Formula: C4H8OMolecular Weight: 72.105720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RBACIKXCRWGCBB-SCSAIBSYSA-N

• (5-Carboxypentyl)(triphenyl)phosphonium bromide
IUPAC Name: 5-carboxypentyl(triphenyl)phosphanium;bromide | CAS Registry Number: 50889-29-7
Synonyms: (5-Carboxypentyl)triphenylphosphonium bromide, (5-carboxypentyl)(triphenyl)phosphonium bromide, (5-Carboxypentyl) triphenyl phosphonium bromide, ACMC-20apmi, AC1MCV6O, 21935_ALDRICH, 21935_FLUKA, CTK3J1203, MolPort-000-144-803, AKOS015961316, AG-F-71506, MCULE-1950631909, RP07141, AC-13548, AK110766, KB-124756, TL8003375, (5-carboxypentyl)triphenylphosphanium bromide, ST50408606, (6-hydroxy-6-oxohexyl)-triphenylphosphanium bromide

Molecular Formula: C24H26BrO2PMolecular Weight: 457.339802 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JUWYRPZTZSWLCY-UHFFFAOYSA-N

• 4,5-Bis(diphenylphosphino)-9,9- dimethylxanthene
IUPAC Name: (5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane | CAS Registry Number: 161265-03-8
Synonyms: Xantphos, 4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene, 9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene, Dimethylbisdiphenylphosphinoxanthene, 4,5-Bis(diphenylphospheno)-9,9-dimethyl xanthene, 4,5-bis-diphenylphosphanyl-9,9-dimethyl-9h-xanthene, 4,5-Bis(diphenylphosphino)-9,9-dimethyl-9H-xanthene, 9,9-dimethyl-4,5-bis(diphenylphosphino)-9H-xanthene, (9,9-dimethyl-9H-xanthene-4,5-diyl)bis(diphenylphosphine), (9,9-DIMETHYL-9H-XANTHENE-4,5-DIYL)BIS(DIPHENYLPHOSPHANE), PubChem15553, ACMC-20a0ao, AC1LCRL4, KSC485M5J, 526460_ALDRICH, MolPort-003-935-880, ACN-S004427, ANW-51310, RW2263, AKOS005145677

Molecular Formula: C39H32OP2Molecular Weight: 578.618304 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CXNIUSPIQKWYAI-UHFFFAOYSA-N

• 2-(4,5-Dichloro-1H-imidazol-1-yl)ethanethioamide
IUPAC Name: 2-(4,5-dichloroimidazol-1-yl)ethanethioamide | CAS Registry Number: 175201-50-0
Synonyms: SBB055869, 2-(4,5-dichloroimidazol-1-yl)ethanethioamide, ZINC02159647, AC1MCTES, CTK4D5396, MolPort-000-144-556, AKOS015908857, AG-E-25062, RP04726, KB-162783, FT-0608572, Y7903, 1-amino-2-(4,5-dichloroimidazolyl)ethane-1-thione, I14-35161

Molecular Formula: C5H5Cl2N3SMolecular Weight: 210.084300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LDYDMLUTTJALOR-UHFFFAOYSA-N

• (6-Iodopyridin-2-Yl)methanol
IUPAC Name: (6-iodopyridin-2-yl)methanol | CAS Registry Number: 851102-41-5
Synonyms: ZINC04352704

Molecular Formula: C6H6INOMolecular Weight: 235.022410 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VUEZKKXLCULZHG-UHFFFAOYSA-N

• 2-Pyridinemethanol, 6-Methoxy-
IUPAC Name: (6-methoxypyridin-2-yl)methanol | CAS Registry Number: 63071-12-5
Synonyms: ZINC04352715

Molecular Formula: C7H9NO2Molecular Weight: 139.151860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OPXGBIUWGAUTER-UHFFFAOYSA-N

• (2-Chloro-1,1,2-Trifluoroethyl)diethylamine
IUPAC Name: 2-chloro-N,N-diethyl-1,1,2-trifluoroethanamine | CAS Registry Number: 357-83-5
Synonyms: CID136184, N,N-Diethyl(2-chloro-1,1,2-trifluoroethyl)amine, LT03383164

Molecular Formula: C6H11ClF3NMolecular Weight: 189.606450 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BDZHKUAKSMWSAJ-UHFFFAOYSA-N

• (2-Furanylmethylene)Malononitrile
IUPAC Name: 2-(furan-2-ylmethylidene)propanedinitrile | CAS Registry Number: 3237-22-7
Synonyms: Furfural-malonitril, Furfurylidenemalononitrile, alpha-isopropylmalate, Tyrphostin deriv. 8, 2-Furfurylidenemalononitrile, Furfural-malonitril [German], MALONONITRILE, FURFURYLIDENE-, RGW 904, 447366_ALDRICH, NSC 1333, 1,1-Dicyano-2-(2-furyl)ethylene, (2-Furanylmethylene)malononitrile, NSC1333, CHEBI:188122, 2-(2-Furylmethylene)malononitrile, CID18606, 2-Furan-2-ylmethylene-malononitrile, ZINC00159884, F 2375, Propanedinitrile, (2-furanylmethylene)-

Molecular Formula: C8H4N2OMolecular Weight: 144.130160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CRUJHLHRJSNZIU-UHFFFAOYSA-N

• (4-Methylphenylthio)Acetone
IUPAC Name: 1-(4-methylphenyl)sulfanylpropan-2-one | CAS Registry Number: 1200-13-1
Synonyms: ZINC00156253, CID2779874, BBV-27097878

Molecular Formula: C10H12OSMolecular Weight: 180.266680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CYDGCRNQPJVYSN-UHFFFAOYSA-N

• (R)-(-)-1-Methyl-3-Phenylpropylamine
IUPAC Name: (2R)-4-phenylbutan-2-amine | CAS Registry Number: 937-52-0
Synonyms: (R)-4-Phenylbutan-2-amine, (R)-(-)-1-Methyl-3-phenylpropylamine, (R)-1-METHYL-3-PHENYLPROPYLAMINE, SureCN605244, AC1MC07K, (2R)-4-phenylbutan-2-amine, CTK8C1447, MolPort-008-266-695, ANW-66599, AKOS015840002, AK-36925, BP-20349, KB-210207, FT-0080304, FT-0605036, I14-62657

Molecular Formula: C10H15NMolecular Weight: 149.232800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WECUIGDEWBNQJJ-SECBINFHSA-N

• (R)-(-)-1,1'-Bi-2-Naphthol Bis(Trifluoromethanesulfonate)
IUPAC Name: 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid | CAS Registry Number: 128575-34-8
Synonyms: lavendustin c, Compound 5, HDBA, 125697-93-0, NSC666251, NSC 666251, 5-(2,5-Dihydroxybenzylamino)salicylic acid, N-(2,5-Dihydroxybenzyl)-5-aminosalicylic acid, 5-(2,5-Dihydroxybenzylamino)-2-hydroxybenzoic acid, 5-[(2,5-dihydroxybenzyl)amino]-2-hydroxybenzoic acid, 5-(N-2′,5′-Dihydroxybenzyl)aminosalicylic Acid, 5-[(2,5-dihydroxyphenyl)methylamino]-2-hydroxybenzoic acid, Benzoic acid,5-[[(2,5-dihydroxyphenyl)methyl]amino]-2-hydroxy-, 5-((2,5-Dihydroxybenzyl)amino)-2-hydroxybenzoic acid, AC1L1GYB, AC1Q5UOH, BiomolKI_000039, ACMC-20c89k, BiomolKI2_000047, SureCN1821516

Molecular Formula: C14H13NO5Molecular Weight: 275.256720 [g/mol]
H-Bond Donor: 5H-Bond Acceptor: 6

InChIKey: LULATDWLDJOKCX-UHFFFAOYSA-N

• 1,1-Dimethoxy-2-(2-Methoxyethoxy)ethane
IUPAC Name: 1,1-dimethoxy-2-(2-methoxyethoxy)ethane | CAS Registry Number: 94158-44-8
Synonyms: EINECS 303-115-7, CID56738, 1,1-DIMETHOXY-2-(2-METHOXYETHOXY)ETHANE

Molecular Formula: C7H16O4Molecular Weight: 164.199540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JPOUJDLGAPEXAN-UHFFFAOYSA-N

• (Dichloromethyl)Dimethylchlorosilane
IUPAC Name: chloro-(dichloromethyl)-dimethylsilane | CAS Registry Number: 18171-59-0
Synonyms: (Dichloromethyl)dimethylchlorosilane, Chloro(dichloromethyl)dimethylsilane, CID87493, (Dichloromethyl)dimethyl chlorosilane, EINECS 242-058-1, Silane, chloro(dichloromethyl)dimethyl-

Molecular Formula: C3H7Cl3SiMolecular Weight: 177.532180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: OICVMMJHLFRGHF-UHFFFAOYSA-N

• (R)-(-)-2-Fluoro-α-Methyl-4-Biphenylacetic Acid
IUPAC Name: (2R)-2-(3-fluoro-4-phenylphenyl)propanoic acid | CAS Registry Number: 51543-40-9
Synonyms: Tarenflurbil, Flurizan, R-Flurbiprofen, Furbiprofen, Flurofen, Antadys, Cebutid, Stayban, Zepolas, Adfeed, Ansaid, Froben, Ocufen, TruNoc, (R)-Flurbiprofen, (-)-Flurbiprofen, (R)-2-Flurbiprofen, Tocris-1769, UNII-501W00OOWA, 545740_ALDRICH

Molecular Formula: C15H13FO2Molecular Weight: 244.260923 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SYTBZMRGLBWNTM-SNVBAGLBSA-N

• (S,S)-(-)-2-Amino-1,2-Diphenylethanol
IUPAC Name: (1S,2S)-2-amino-1,2-diphenylethanol | CAS Registry Number: 23190-17-2
Synonyms: (1S,2S)-2-Amino-1,2-diphenyl-ethanol, trans-2-amino-1,2-diphenyl-ethanol, (1S,2S)-(-)-2-Amino-1,2-diphenylethanol, (S,S)-(-)-2-Amino-1,2-diphenylethanol, AC1LEXZ4, SureCN2763479, AC1Q59F3, CTK4F1058, AR-1L7013, AG-E-67427, (1S,2S)-2-amino-1,2-diphenylethanol, AC-10492, Benzeneethanol, b-amino-a-phenyl-, (aS,bS)-, Benzeneethanol,b-amino-a-phenyl-, [S-(R*,R*)]-;Ethanol,2-amino-1,2-diphenyl-, (1S,2S)-threo-(-)- (8CI);(1S,2S)-2-Amino-1,2-diphenylethanol;(S,S)-2-Amino-1,2-diphenyl-1-ethanol;

Molecular Formula: C14H15NOMolecular Weight: 213.275000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GEJJWYZZKKKSEV-KBPBESRZSA-N

• (R)-(+)-N,N-Dimethyl-1-(1-Naphthyl)ethylamine
IUPAC Name: (1R)-N,N-dimethyl-1-naphthalen-1-ylethanamine | CAS Registry Number: 119392-95-9
Synonyms: ST51038401, (R)-(+)-N,N-Dimethyl-1-(1-naphthyl)ethylamine, 461490_ALDRICH, CTK4B1260, ((1R)-1-naphthylethyl)dimethylamine, AKOS015894830, AG-D-42282, I05-2644, (R)-(+)-N,N-DIMETHYL-1-(NAPHTHALEN-1-YL)ETHYLAMINE

Molecular Formula: C14H17NMolecular Weight: 199.291480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AXRXYILTIWBHEP-LLVKDONJSA-N

• (R)-(-)-N-Benzyl-1-(1-Naphthyl)ethylamine Hydrochloride
IUPAC Name: (1R)-N-benzyl-1-naphthalen-1-ylethanamine;hydrochloride | CAS Registry Number: 163831-65-0
Synonyms: (R)-(-)-N-Benzyl-1-(1-naphthyl)ethylamine hydrochloride, 445959_ALDRICH, SCHEMBL3067899, CTK8E2788, AKOS015910800, AK-60072, RT-023877, (R)-N-[1-(1-Naphthyl)ethyl]benzylamine hydrochloride, I14-39989, (R)-N-Benzyl-1-(naphthalen-1-yl)ethanamine hydrochloride

Molecular Formula: C19H20ClNMolecular Weight: 297.821800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: KCLJDAVYFCDIDY-XFULWGLBSA-N

• 4-Amino-3-(4-Chloro-Phenyl)-Butyric Acid
IUPAC Name: (3R)-4-amino-3-(4-chlorophenyl)butanoic acid | CAS Registry Number: 69308-37-8
Synonyms: d-Baclofen, baclofen, (R)-Baclofen, (-)-Baclofen, R-(-)-Baclofen, (R)-(-)-Baclofen, Tocris-0796, CHEBI:181559, MolPort-002-507-841, BB_SC-2100, CID44602, NCGC00024796-01, (R)-4-Amino-3-(4-chlorophenyl)butanoic acid, 4-Amino-3-(4-chloro-phenyl)-butyric acid, LS-182284, (R)-4-Amino-3-(4-chloro-phenyl)-butyric acid, Benzenepropanoic acid, beta-(aminomethyl)-4-chloro-, (R)-, Benzeneporopanoic acid, (beta-(aminomethyl)-4-chloro-, (betaR)-

Molecular Formula: C10H12ClNO2Molecular Weight: 213.660780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: KPYSYYIEGFHWSV-QMMMGPOBSA-N


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