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Beckmann-Kenko GmbH

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Profile: Beckmann-Kenko GmbH deals with fine and specialty chemicals. Our products include acetamidine hcl, 3'-acetamidoacetophenone, acetoacet-2,5-dimethoxy-4-chloroanilide, alpha-acetoxyisobutyryl bromide, acetylacetone, aleuritic acid, allylcyanide, aluminumbromide, 4-aminoacetophenone, amino acids, 2-aminobenzylalcohol and 4-amino-1-benzylpiperidine.

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• 2-Ethyl-1,3-Cyclopentanedione
IUPAC Name: 2-ethyl-3-hydroxycyclopent-2-en-1-one | CAS Registry Number: 823-36-9
Synonyms: ZINC01845656, CID138610, 2-Cyclopenten-1-one,2-ethyl-3-hydroxy-, 2-Cyclopenten-1-one, 2-ethyl-3-hydroxy-, 5857-25-0

Molecular Formula: C7H10O2Molecular Weight: 126.153100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RDXQMMNEMFSXDO-UHFFFAOYSA-N

• 2-Hydroxy Phenyl Acetic Acid
IUPAC Name: 2-(2-hydroxyphenyl)acetic acid | CAS Registry Number: 614-75-5
Synonyms: 2-Hydroxyphenylacetate, 2-Hydroxyphenylacetic acid, Benzeneacetic acid, 2-hydroxy-, Hydroxyphenylacetic acid, (2-Hydroxyphenyl)acetic acid, 2-Hydroxybenzeneacetic acid, Acetic acid, (o-hydroxyphenyl)-, o-Hydroxy phenylacetic acid, 2-Hydroxyphenyl acetic acid, (o-Hydroxyphenyl)acetic acid, H49804_ALDRICH, O-HYDROXYPHENYLACETIC ACID, NSC62000, EINECS 210-393-2, NSC 62000, (2-HYDROXYPHENYL)-ACETIC ACID, Acetic acid, (o-hydroxyphenyl)- (8CI), SB 01717, C05852, H-7080

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: CCVYRRGZDBSHFU-UHFFFAOYSA-N

• 2-Hydroxy-4-MethoxyBenzophenone-5-Sulfonic Acid Sodium Salt
IUPAC Name: 5-(benzoyl)-4-hydroxy-2-methoxybenzenesulfonic acid | CAS Registry Number: 6628-37-1
Synonyms: Sulisobenzone, Sungard, Sulisobenzona, Sulisobenzonum, Uvinul, Uval, Benzophenone 4, Benzophenone-4, Uval sodium salt, Uvinuc ms 40, Seesorb 101S, Syntase 230, Uvinul MS 40, UV Absorber HMBS, Sungard (TN), HMBS, SULISOBENZENE, Uvinul MS-40 substanz, Spectra-Sorb UV 284, Uval (*sodium salt*)

Molecular Formula: C14H12O6SMolecular Weight: 308.306480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CXVGEDCSTKKODG-UHFFFAOYSA-N

• 2-Isopropylimidazole
IUPAC Name: 2-propan-2-yl-1H-imidazole | CAS Registry Number: 36947-68-9
Synonyms: 2-Isopropyl-1H-imidazole, 1H-Imidazole, 2-(1-methylethyl)-, 373990_ALDRICH, EINECS 253-286-6, ZINC00389816, InChI=1/C6H10N2/c1-5(2)6-7-3-4-8-6/h3-5H,1-2H3,(H,7,8

Molecular Formula: C6H10N2Molecular Weight: 110.157000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FUOZJYASZOSONT-UHFFFAOYSA-N

• 2-Methyl-4-Isothiazolin-3-One
IUPAC Name: 2-methyl-1,2-thiazol-3-one hydrochloride | CAS Registry Number: 2682-20-4
Synonyms: MLS001332655, MLS001332656, M6045_SIGMA, EINECS 247-499-3, 2-Methyl-4-isothiazolin-3-one hydrochloride, 2-Methyl-3-isothiazolone hydrochloride, SMR000875225, 2-Methyl-2H-isothiazol-3-one hydrochloride, 3(2H)-Isothiazolone, 2-methyl-, hydrochloride, 116680-95-6, 26172-54-3, MIT

Molecular Formula: C4H6ClNOSMolecular Weight: 151.614540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SJXPQSRCFCPWQQ-UHFFFAOYSA-N

• 2-Methylpyrazine- 5-Carboxylic Acid
IUPAC Name: 5-methylpyrazine-2-carboxylic acid | CAS Registry Number: 5521-55-1
Synonyms: 5-Methyl-2-pyrazinecarboxylic acid, 2-Methylpyrazine-5-carboxylic acid, 347647_ALDRICH, AIDS044806, Pyrazinecarboxylic acid, 5-methyl-, AIDS-044806, CID122831, SBB006622, NCGC00167497-01, TL806280

Molecular Formula: C6H6N2O2Molecular Weight: 138.124040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RBYJWCRKFLGNDB-UHFFFAOYSA-N

• 2-Methylresorcinol
IUPAC Name: 2-methylbenzene-1,3-diol | CAS Registry Number: 608-25-3
Synonyms: 2-Methylresorcin, 2,6-Dihydroxytoluene, Resorcinol, 2-methyl-, Toluene-2,6-diol, 1,3-Benzenediol, 2-methyl-, 2-Methyl-1,3-benzenediol, Ambap2918, 2-methylbenzene-1,3-diol, 2-Methyl-1,3-dihydroxybenzene, M80407_ALDRICH, 302589_ALDRICH, 1,3-DIHYDROXY-2-METHYLBENZENE, 37960_FLUKA, EINECS 210-155-8, NSC 66524, NSC66524, BRN 2042177, ZINC00154621, AI3-61050, LS-1447

Molecular Formula: C7H8O2Molecular Weight: 124.137220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ZTMADXFOCUXMJE-UHFFFAOYSA-N

• 2,3-Dichloro Aniline
IUPAC Name: 2,3-dichloroaniline | CAS Registry Number: 608-27-5
Synonyms: 2,3-DICHLOROANILINE, Dichloroanilines, Aniline, 2,3-dichloro-, Benzenamine, 2,3-dichloro-, 2,3-Dichlorobenzenamine, 2,3-Dichloranilin, DICHLOROANILINE, Ar,ar-dichlorobenzenamine, Benzenamine, ar,ar-dichloro-, D55407_ALDRICH, HSDB 5433, 36701_RIEDEL, 35160_FLUKA, CHEBI:46636, EINECS 210-157-9, NSC 60683, Aniline, 2,3-dichloro- (7CI,8CI), NSC60683, UN1590, ZINC00388504

Molecular Formula: C6H5Cl2NMolecular Weight: 162.016600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BRPSAOUFIJSKOT-UHFFFAOYSA-N

• 2,6-DichloroPurine
IUPAC Name: 2,6-dichloro-7H-purine | CAS Registry Number: 5451-40-1
Synonyms: 2,6-Dichloropurine, 2, 6-Dichloropurine, Purine, 2,6-dichloro-, 2,6-dichloro-9H-purine, 2,6-Dichloro-1H-purine, 1H-Purine, 2,6-dichloro-, 2,6-DICHLORO PURINE, D73103_ALDRICH, 9H-purine, 2,6-dichloro-, 36390_FLUKA, AIDS021810, BM032, AIDS-021810, NSC18395, EINECS 226-681-6, NSC 18395, SBB000271, ZINC01769175, 1H-Purine, 2,6-dichloro- (9CI), KS-1014

Molecular Formula: C5H2Cl2N4Molecular Weight: 189.002180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RMFWVOLULURGJI-UHFFFAOYSA-N

• 3-Methyl Xanthine
IUPAC Name: 3-methyl-7H-purine-2,6-dione | CAS Registry Number: 1076-22-8
Synonyms: 3-Methylxanthine, Purine analog, Xanthine, 3-methyl-, Ambap7379, Spectrum_001898, SpecPlus_000737, Spectrum2_000502, Spectrum3_001652, Spectrum4_001571, Spectrum5_001544, 3 MX, 3-METHYL XANTHINE, CCRIS 5817, Oprea1_233226, Oprea1_288071, BSPBio_003403, KBioGR_002122, KBioSS_002428, DivK1c_006833, SPECTRUM1504182

Molecular Formula: C6H6N4O2Molecular Weight: 166.137440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GMSNIKWWOQHZGF-UHFFFAOYSA-N

• 3-Methyl-4-NitroBenzoic Acid
IUPAC Name: 3-methyl-4-nitrobenzoic acid | CAS Registry Number: 3113-71-1
Synonyms: 3-Methyl-4-nitrobenzoic acid, 4-Nitro-m-toluic acid, m-Toluic acid, 4-nitro-, Benzoic acid, 3-methyl-4-nitro-, M60600_ALDRICH, MLS002152884, TPC-B002, TPC-I001, EINECS 221-479-4, NSC 28455, NSC28455, 3-METHYL-4-NITRO-BENZOIC ACID, LS-1170, NCGC00091302-01, SB 01931, SMR001224497, ST5406139, TL8002381, M-4215

Molecular Formula: C8H7NO4Molecular Weight: 181.145480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: XDTTUTIFWDAMIX-UHFFFAOYSA-N

• 3-Pyridine sulfonic Acid
IUPAC Name: pyridine-3-sulfonic acid | CAS Registry Number: 636-73-7
Synonyms: 3-Pyridinesulfonic acid, 3-Sulfopyridine, beta-Sulfopyridine, 3-Pyridylsulfonic acid, Pyridine-3-sulphonic acid, pyridine-3-sulfonic acid, 82820_FLUKA, EINECS 211-265-9, AIDS167203, AIDS-167203, BRN 0120822, AI3-52418, LS-131984, ST5186530, TL8004454, 5-22-07-00552 (Beilstein Handbook Reference), AC-907/25014067

Molecular Formula: C5H5NO3SMolecular Weight: 159.163100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DVECLMOWYVDJRM-UHFFFAOYSA-N

• 4-(Methyl amino)-Benzoic Acid
IUPAC Name: 4-(methylamino)benzoic acid | CAS Registry Number: 10541-83-0
Synonyms: p-Methylaminobenzoic acid, 4-Methylaminobenzoic acid, Benzoic acid, 4-(methylamino)-, p-(Methylamino)benzoic acid, Maybridge3_003350, 4-(Methylamino)benzoic acid, N-Methyl-4-aminobenzoate, Benzoic acid, p-(methylamino)-, N-Methyl-4-aminobenzoic acid, 4-(N-Methylamino)benzoic acid, Oprea1_065286, 119695_ALDRICH, AIDS020030, AIDS-020030, EINECS 234-121-7, JFD 03586, NSC102506, NSC 102506, Benzoic acid, p-(methylamino)- (8CI), IDI1_014737

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZVIDMSBTYRSMAR-UHFFFAOYSA-N

• 4-Amino Diphenyl Ether
IUPAC Name: 4-(phenoxy)aniline | CAS Registry Number: 139-59-3
Synonyms: p-Phenoxyaniline, Aniline, p-phenoxy-, Benzenamine, 4-phenoxy-, 4-PHENOXYANILINE, 4-Aminodiphenyl ether, 4-Aminodiphenylether, 4-Phenoxybenzenamine, 4-Aminobiphenyl ether, 4-Aminodifenylether, 4-Aminophenyl phenyl ether, 4-Amino-1-phenoxybenzene, p-Aminophenyl phenyl ether, Ether, 4-aminophenyl phenyl, WLN: ZR DOR, 4-Aminodifenylether [Czech], ChemDiv3_000338, CCRIS 3561, Oprea1_328270, P15102_ALDRICH, NSC 4629

Molecular Formula: C12H11NOMolecular Weight: 185.221840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WOYZXEVUWXQVNV-UHFFFAOYSA-N

• 4-Diethylamino benzoic Acid
IUPAC Name: 4-(diethylamino)benzoic acid | CAS Registry Number: 5429-28-7
Synonyms: 4-(Diethylamino)benzoic acid, ChemDiv3_014193, 4-N,N-Diethylaminobenzoic acid, Oprea1_667232, p-(Diethylamino)benzoic acid, MLS000586673, Benzoic acid, 4-(diethylamino)-, 237353_ALDRICH, NSC14115, EINECS 226-582-8, NSC 14115, IDI1_029991, SMR000208052, ST5213890, EU-0033312, InChI=1/C11H15NO2/c1-3-12(4-2)10-7-5-9(6-8-10)11(13)14/h5-8H,3-4H2,1-2H3,(H,13,14

Molecular Formula: C11H15NO2Molecular Weight: 193.242300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LNYTUARMNSFFBE-UHFFFAOYSA-N

• 4-Hydroxy Cinnamic Acid
IUPAC Name: (E)-3-(4-hydroxyphenyl)prop-2-enoic acid | CAS Registry Number: 7400-08-0
Synonyms: p-coumaric acid, p-Hydroxycinnamic acid, 4-Coumaric acid, Naringeninic acid, Para-Coumaric acid, p-Cumaric acid, 4-Hydroxycinnamic acid, trans-p-Coumaric acid, 4-coumarate, Hydroxycinnamic acid, (E)-p-Coumaric acid, 4-Hydroxycinnamate, trans-p-Coumarinic acid, p-Coumaric acid,trans, Cinnamic acid, p-hydroxy-, p-Hydroxyphenylacrylic acid, trans-4-Hydroxycinnamic acid, trans-4-coumaric acid, (E)-p-Hydroxycinnamic acid, trans-p-Hydroxycinnamic acid

Molecular Formula: C9H8O3Molecular Weight: 164.158020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NGSWKAQJJWESNS-ZZXKWVIFSA-N

• 4-HydroxyPhenyl Ethanol
IUPAC Name: 4-(2-hydroxyethyl)phenol | CAS Registry Number: 501-94-0
Synonyms: Tyrosol, 4-Hydroxyphenylethanol, Benzeneethanol, 4-hydroxy-, 2-(4-Hydroxyphenyl)ethanol, 4-Hydroxybenzeneethanol, p-Hydroxyphenethyl alcohol, 4-(2-Hydroxyethyl)phenol, p-hydroxyphenylethanol, 4-Hydroxyphenethyl alcohol, MLS001332423, MLS001332424, 188255_ALDRICH, CHEBI:1879, 79058_FLUKA, EINECS 207-930-8, NSC 59876, CPD3O-4151, 2-(P-HYDROXYPHENYL)ETHANOL, CID10393, NSC59876

Molecular Formula: C8H10O2Molecular Weight: 138.163800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YCCILVSKPBXVIP-UHFFFAOYSA-N

• 4-Hydroxyphenyl amine
IUPAC Name: 4-(anilino)phenol | CAS Registry Number: 122-37-2
Synonyms: p-Anilinophenol, 4-Anilinophenol, p-Oxydiphenylamine, p-Hydroxydiphenylamine, Phenyl-p-aminophenol, Phenol, p-anilino-, 4-Phenylaminophenol, Phenol, 4-(phenylamino)-, 4-Hydroxydiphenylamine, N-Phenyl-p-aminophenol, p-Hydroxydifenylamin, P-ANILINO-PHENOL, Diphenylamine, 4-hydroxy-, p-(Phenylamino)phenol, VTI 1, WLN: QR DMR, p-Hydroxydifenylamin [Czech], para-Hydroxydifenylamin [Czech], Oprea1_025350, NSC1543

Molecular Formula: C12H11NOMolecular Weight: 185.221840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JTTMYKSFKOOQLP-UHFFFAOYSA-N

• 4-MercaptoBenzoic Acid
IUPAC Name: 4-sulfanylbenzoic acid | CAS Registry Number: 1074-36-8
Synonyms: 4-Mercaptobenzoate, para-Mercaptobenzoate, Benzoic acid, 4-mercapto-, 4-Mercaptobenzoic acid, Benzoic acid, p-mercapto-, 4-Mercapto benzoic acid, 662534_ALDRICH, NSC32022, NSC 32022, TL8006762

Molecular Formula: C7H6O2SMolecular Weight: 154.186340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LMJXSOYPAOSIPZ-UHFFFAOYSA-N

• 4-Methoxyphenethyl Alcohol
IUPAC Name: 2-(4-methoxyphenyl)ethanol | CAS Registry Number: 702-23-8
Synonyms: 4-Methoxyphenethyl alcohol, 2-(4-Methoxyphenyl)ethanol, p-Methoxyphenethyl alcohol, Ambap3007, Benzeneethanol, 4-methoxy-, 154180_ALDRICH, 2-(p-Methoxyphenyl)ethyl alcohol, CID69705, EINECS 211-866-6, NSC408325, ZINC00388333, NSC 408325, AI3-05522, TL8004953

Molecular Formula: C9H12O2Molecular Weight: 152.190380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AUWDOZOUJWEPBA-UHFFFAOYSA-N

• 4-Nitrobenzene sulfonyl chloride
IUPAC Name: 4-nitrobenzenesulfonyl chloride | CAS Registry Number: 98-74-8
Synonyms: 4-Nitrobenzenesulfonyl chloride, 4-Nitrobenzenesulphonyl chloride, p-Nitrophenylsulfonyl chloride, 4-Nitrophenylsulfonyl chloride, Benzenesulfonyl chloride, p-nitro-, 170925_ALDRICH, 272248_ALDRICH, Benzenesulfonyl chloride, 4-nitro-, STOCK2S-65078, 4-Nitrobenzenesulfonic acid chloride, NSC9572, P-NITROBENZENESULFONYL CHLORIDE, NSC13065, EINECS 202-697-9, NSC 13065, Benzenesulfonyl chloride, p-nitro- (8CI), AI3-52248, TL8006052

Molecular Formula: C6H4ClNO4SMolecular Weight: 221.618260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JXRGUPLJCCDGKG-UHFFFAOYSA-N

• 4,6-Dichloro-5-AminoPyrimidine
IUPAC Name: 4,6-dichloropyrimidin-5-amine | CAS Registry Number: 5413-85-4
Synonyms: 5-Amino-4,6-dichloropyrimidine, 5-Pyrimidinamine, 4,6-dichloro-, 4,6-Dichloropyrimidin-5-ylamine, 4,6-Dichloro-5-aminopyrimidine, NSC7851, 217735_ALDRICH, 07690_FLUKA, Pyrimidine, 5-amino-4,6-dichloro-, CID79434, NSC 7851, EINECS 226-503-7, SBB003920, ZINC01581331, AI3-52090, TL80073606, AB-323/25048131, 6045-36-9

Molecular Formula: C4H3Cl2N3Molecular Weight: 163.992720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NIGDWBHWHVHOAD-UHFFFAOYSA-N

• 6-Amino-2,4-Dichloro pyrimidine
IUPAC Name: 2,6-dichloropyrimidin-4-amine | CAS Registry Number: 10132-07-7
Synonyms: 4-Amino-2,6-dichloropyrimidine, 4-Pyrimidinamine, 2,6-dichloro-, 6-Amino-2,4-dichloropyrimidine, 2,6-Dichloropyrimidin-4-amine, 679070_ALDRICH, NSC51667, EINECS 233-369-3, NSC 51667, Pyrimidine, 4-amino-2,6-dichloro-, SBB015042, ZINC01682788, TL8000086, Pyrimidine, 4-amino-2,6-dichloro- (8CI)

Molecular Formula: C4H3Cl2N3Molecular Weight: 163.992720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UPVBKNZVOJNQKE-UHFFFAOYSA-N

• 8-Benzyltheophylline
IUPAC Name: 1,3-dimethyl-8-(phenylmethyl)-7H-purine-2,6-dione | CAS Registry Number: 2879-15-4
Synonyms: Theophylline, 8-benzyl-, Oprea1_363271, EINECS 220-725-8, NSC 14131, NSC14131, ZINC01596689, LS-149421, 8-Benzyl-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(phenylmethyl)-

Molecular Formula: C14H14N4O2Molecular Weight: 270.286560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SWKGFZTXWQMFLK-UHFFFAOYSA-N

• 4-Hydroxy Butyrophenone
IUPAC Name: 4-(4-hydroxyphenyl)butan-2-one | CAS Registry Number: 5471-51-2
Synonyms: Raspberry ketone, Oxyphenalon, Frambinone, Rheosmin, Rasketone, Betuligenol, rasberry ketone, p-Hydroxybenzyl acetone, 4-(3-Oxobutyl)phenol, 4-(4-Hydroxyphenyl)-2-butanone, Hydroxyphenylbutanone, p-, (p-Hydroxybenzyl)acetone, 2-Butanone, 4-(4-hydroxyphenyl)-, p-hydroxyphenylbutan-2-one, 1-(p-Hydroxyphenyl)-3-butanone, 4-(p-Hydroxyphenyl)-2-butanone, FEMA No. 2588, WLN: QR D2V1, W258806_ALDRICH, W258814_ALDRICH

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NJGBTKGETPDVIK-UHFFFAOYSA-N

• 4-Aminophenol
IUPAC Name: 4-aminophenol | CAS Registry Number: 123-30-8
Synonyms: 4-aminophenol, p-aminophenol, 4-hydroxyaniline, p-hydroxyaniline, Certinal, Paranol, Citol, Azol, 4-aminobenzenol, Phenol, 4-amino-, Activol, Rodinal, Phenol, p-amino-, Fouramine P, Benzofur P, Fourrine P Base, Pelagol P Base, Tertral P Base, Ursol P, Furro P Base

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PLIKAWJENQZMHA-UHFFFAOYSA-N

• 2-Methylbenzoic Acid
IUPAC Name: 2-methylbenzoic acid | CAS Registry Number: 118-90-1
Synonyms: 2-Methylbenzoic acid, O-TOLUIC ACID, Orthotoluic acid, o-Toluylic acid, Toluic acid, 2-Toluic acid, Benzoic acid, 2-methyl-, o-Methylbenzoic acid, o-Methylbenzoate, o-Toluate, Benzoic acid, methyl-, WLN: QVR B1, T36404_ALDRICH, MLS002152917, BENZOIC ACID,2-METHYL, NSC 2193, CHEBI:36632, EINECS 204-284-9, NSC2193, AIDS018011

Molecular Formula: C8H8O2Molecular Weight: 136.147920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZWLPBLYKEWSWPD-UHFFFAOYSA-N

• 2-Nitro Benzene Sulphonyl Chloride
IUPAC Name: 2-nitrobenzenesulfonyl chloride | CAS Registry Number: 1694-92-4
Synonyms: 2-Nitrobenzenesulfonyl chloride, o-Nitrophenylsulfonyl chloride, o-Nitrobenzenesulfonyl chloride, 2-Nitrobenzenesulfonylchloride, Benzenesulfonyl chloride, 2-nitro-, N11507_ALDRICH, Benzenesulfonyl chloride, o-nitro-, 2-Nitrobenzenesulphonyl chloride, NSC12991, EINECS 216-907-1, NSC 12991, O-NITROBENZENESULPHONYL CHLORIDE, Benzenesulfonyl chloride, o-nitro- (8CI), TL8001322

Molecular Formula: C6H4ClNO4SMolecular Weight: 221.618260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WPHUUIODWRNJLO-UHFFFAOYSA-N

• 4-Hydroxybenzaldehyde
IUPAC Name: 4-hydroxybenzaldehyde | CAS Registry Number: 123-08-0
Synonyms: p-Hydroxybenzaldehyde, 4-hydroxybenzaldehyde, p-Formylphenol, 4-Formylphenol, p-Oxybenzaldehyde, Benzaldehyde, 4-hydroxy-, Benzaldehyde, p-hydroxy-, Parahydroxybenzaldehyde, USAF M-6, WLN: VHR DQ, 4-HYDROXY-BENZALDEHYDE, W398403_ALDRICH, 144088_ALDRICH, CID126, NSC 2127, 54590_FLUKA, CHEBI:17597, EINECS 204-599-1, NSC2127, 1k03

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RGHHSNMVTDWUBI-UHFFFAOYSA-N

• 4-Methoxy-Phenyl-Acetic Acid
IUPAC Name: 2-(4-methoxyphenyl)acetic acid | CAS Registry Number: 104-01-8
Synonyms: Homoanisic acid, Benzeneacetic acid, 4-methoxy-, p-Methoxyphenylacetic acid, 2-(p-Anisyl)acetic acid, MOPA, 4-Methoxyphenylacetic acid, 4-Methoxybenzeneacetic acid, (4-Methoxyphenyl)acetic acid, Acetic acid, (p-methoxyphenyl)-, Acetic acid, p-methoxyphenyl-, WLN: QV1R DO1, NCIOpen2_000187, (p-Methoxyphenyl)acetic acid, M19201_ALDRICH, EINECS 203-166-4, NSC 27799, AIDS017837, P-METHOXYPHENYLACETIC ACID, AIDS-017837, NSC27799

Molecular Formula: C9H10O3Molecular Weight: 166.173900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NRPFNQUDKRYCNX-UHFFFAOYSA-N

• 4-Pyridine Methanol
IUPAC Name: pyridin-4-ylmethanol | CAS Registry Number: 586-95-8
Synonyms: 4-Pyridylcarbinol, 4-Pyridylmethanol, 4-PYRIDINEMETHANOL, 4-Pyridinecarbinol, 4-Picolyl alcohol, .gamma.-Picolyl alcohol, gamma-Picolyl alcohol, 4-(Hydroxymethyl)pyridine, 4-Pyridyl carbinol, Pyridine-4-methanol, 4-Hydroxymethylpyridine, omega-Hydroxy-4-picoline, PYRIDIN-4-YLMETHANOL, 151629_ALDRICH, 55790_FLUKA, EINECS 209-590-6, NSC 26024, NSC 49167, CID11472, NSC26024

Molecular Formula: C6H7NOMolecular Weight: 109.125880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PTMBWNZJOQBTBK-UHFFFAOYSA-N

• 4-Tertiary Butyl Phenol
IUPAC Name: 4-tert-butylphenol | CAS Registry Number: 98-54-4
Synonyms: Butylphen, 4-tert-Butylphenol, p-tert-Butylphenol, p-t-Butyl phenol, 4-t-Butylphenol, Phenol, p-tert-butyl-, p-sec-Butylphenol, p-terc.Butylfenol, PTBP, Ucar butylphenol 4-T, Caswell No. 130E, 4-(1,1-Dimethylethyl)phenol, 2-TERT-BUTYLPHENOL, Phenol, p-(tert-butyl)-, 4-tertiary-butylphenol, Ambap5870, Phenol, 4-(1,1-dimethylethyl)-, p-terc.Butylfenol [Czech], para-tertiary-butylphenol, Ucar butylphenol 4-T flake

Molecular Formula: C10H14OMolecular Weight: 150.217560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: QHPQWRBYOIRBIT-UHFFFAOYSA-N

• 4-Tolunitrile
IUPAC Name: 4-methylbenzonitrile | CAS Registry Number: 104-85-8
Synonyms: p-Tolunitrile, p-Cyanotoluene, p-Toluonitrile, p-Tolylnitrile, p-Toluenenitrile, 4-Cyanotoluene, p-Toluic nitrile, p-Methylbenzonitrile, Benzonitrile, 4-methyl-, 4-METHYLBENZONITRILE, p-Tolunitril, 4-Methylcyanobenzene, p-Tolunitril [Czech], 1-Methyl-4-cyanobenzene, 4-Toluenkarbonitril [Czech], Nitril kyseliny p-toluylove, WLN: NCR D1, CCRIS 4737, 132330_ALDRICH, EINECS 203-244-8

Molecular Formula: C8H7NMolecular Weight: 117.147880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VCZNNAKNUVJVGX-UHFFFAOYSA-N

• 5-Aminosalicylic Acid
IUPAC Name: 5-amino-2-hydroxybenzoic acid | CAS Registry Number: 89-57-6
Synonyms: mesalamine, Mesalazine, Pentasa, 5-Aminosalicylic acid, Asacol, Rowasa, Claversal, Salofalk, Canasa, Lialda, Mesalazina, Mesalazinum, Mesavance, Mezavant, m-Aminosalicylic acid, Mesasal, Apriso, Iialda, 5-Aminosalicylate, Mesalazine MMX

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: KBOPZPXVLCULAV-UHFFFAOYSA-N

• 5-Chloro-2-Pentanone
IUPAC Name: 5-chloropentan-2-one | CAS Registry Number: 5891-21-4
Synonyms: 1-Chloro-4-pentanone, 5-Chloro-2-pentanone, 2-Pentanone, 5-chloro-, 2-Pentanone 5-chloro-, 5-Chloropentan-2-one, 3-Chloropropyl methyl ketone, ACETYLPROPYL CHLORIDE, Methyl 3-chloropropyl ketone, C62603_ALDRICH, NSC 8427, 25791_FLUKA, EINECS 227-565-8, NSC8427, NSC 60210, NSC60210, ZINC01586735, AI3-08709, LS-101919

Molecular Formula: C5H9ClOMolecular Weight: 120.577360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XVRIEWDDMODMGA-UHFFFAOYSA-N

• 5-Fluorocytidine
IUPAC Name: 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidin-2-one | CAS Registry Number: 2341-22-2
Synonyms: CYTIDINE, 5-FLUORO-, 543020_ALDRICH, CHEBI:38190, ZINC04255900, LS-59078, TL8001942

Molecular Formula: C9H12FN3O5Molecular Weight: 261.207083 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 7

InChIKey: STRZQWQNZQMHQR-UAKXSSHOSA-N

• 5-Nitroindole
IUPAC Name: 5-nitro-1H-indole | CAS Registry Number: 6146-52-7
Synonyms: 5-Nitro-1H-indole, 1H-Indole, 5-nitro-, INDOLE, 5-NITRO-, CCRIS 3255, Oprea1_492280, N17602_ALDRICH, EINECS 228-153-0, 1H-Indole, 5-nitro- (9CI), NSC520594, ZINC00105247, LS-83315, SB 01605, ST5406179, TL8003894, N-3000

Molecular Formula: C8H6N2O2Molecular Weight: 162.145440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OZFPSOBLQZPIAV-UHFFFAOYSA-N

• 8-Hydroxyquinoline
IUPAC Name: quinolin-8-ol | CAS Registry Number: 148-24-3
Synonyms: Oxyquinoline, 8-quinolinol, Oxine, 8-HYDROXYQUINOLINE, Phenopyridine, Oxychinolin, Quinophenol, Bioquin, Tumex, Oxybenzopyridine, Oxin, quinolin-8-ol, 8-Oxyquinoline, 8-Quinol, 8-Hydroxychinolin, Fennosan, Albisal, Hydroxybenzopyridine, Fennosan H 30, Hydroxychinolin

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MCJGNVYPOGVAJF-UHFFFAOYSA-N

• 2-Aminoacetic Acid
IUPAC Name: 2-aminoacetic acid | CAS Registry Number: 56-40-6
Synonyms: glycine, aminoacetic acid, Glycocoll, Aminoethanoic acid, Glycolixir, Glycosthene, Leimzucker, Glicoamin, Aciport, Amitone, Glycin, Padil, Aminoazijnzuur, polyglycine, Acetic acid, amino-, Corilin, Hampshire glycine, L-Glycine, 2-Aminoacetic acid, Sucre de gelatine

Molecular Formula: C2H5NO2Molecular Weight: 75.066600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DHMQDGOQFOQNFH-UHFFFAOYSA-N

• 1,4-Chinone
IUPAC Name: cyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 106-51-4
Synonyms: p-benzoquinone, Quinone, Benzoquinone, Chinone, p-Quinone, para-Quinone, Steara pbq, Cyclohexadienedione, 1,4-BENZOQUINONE, 1,4-Benzoquine, 1,4-Dioxybenzene, para-Benzoquinone, Benzo-1,4-quinone, Chinon, Benzo-chinon, 1,4-Cyclohexadienedione, 2,5-Cyclohexadiene-1,4-dione, p-Chinon, Semiquinone anion, p-Chinon [German]

Molecular Formula: C6H4O2Molecular Weight: 108.094760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AZQWKYJCGOJGHM-UHFFFAOYSA-N

• 1-8-Octanediol
IUPAC Name: octane-1,8-diol | CAS Registry Number: 629-41-4
Synonyms: 1,8-Octanediol, Octamethylene glycol, Octane-1,8-diol, Octan-1,8-diol, O3303_ALDRICH, 74840_FLUKA, CHEBI:44630, AIDS017557, AIDS-017557, CID69420, NSC81228, EINECS 211-090-8, ZINC01574321, TL8004325, C14218, O-1000, ODI

Molecular Formula: C8H18O2Molecular Weight: 146.227320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: OEIJHBUUFURJLI-UHFFFAOYSA-N

• 1-Amino 4-Methyl Piperazine
IUPAC Name: 4-methylpiperazin-1-amine | CAS Registry Number: 6928-85-4
Synonyms: 1-Amino-4-methylpiperazine, 1-Piperazinamine, 4-methyl-, 4-Methylpiperazin-1-amine, A65131_ALDRICH, 255688_ALDRICH, NSC80649, CID81349, EINECS 230-053-7, NSC 80649, SBB004299, 1-Amino-4-methylpiperazine dihydrochloride monohydrate

Molecular Formula: C5H13N3Molecular Weight: 115.176820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: RJWLLQWLBMJCFD-UHFFFAOYSA-N

• 2,4-Difluoronitrobenzene
IUPAC Name: 2,4-difluoro-1-nitrobenzene | CAS Registry Number: 446-35-5
Synonyms: 2,4-Difluoro-1-nitrobenzene, 1,3-Difluoro-4-nitrobenzene, 1-Nitro-2,4-difluorobenzene, Benzene, 2,4-difluoro-1-nitro-, MLS001055483, 233226_ALDRICH, EINECS 207-167-0, NSC 10259, NSC10259, BRN 2048034, ZINC00164453, NCGC00090989-01, LS-29844, SMR001227187, 4-05-00-00720 (Beilstein Handbook Reference)

Molecular Formula: C6H3F2NO2Molecular Weight: 159.090326 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: RJXOVESYJFXCGI-UHFFFAOYSA-N

• 2-(2-Thienyl)Ethanol
IUPAC Name: 2-thiophen-2-ylethanol | CAS Registry Number: 5402-55-1
Synonyms: 2-Thiopheneethanol, 2-(2-Thienyl)ethanol, Thiophen-2-ethanol, 2-(2-Hydroxyethyl)thiophene, 2-(2-Thienyl)-ethanol, 2-thiophen-2-yl-ethanol, Ethanol, 2-(2-thienyl)-, T27855_ALDRICH, NSC5136, 95488_FLUKA, CID79400, NSC 5136, EINECS 226-452-0, ZINC00391955, FS011370, ST5437475, TL8003542

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

InChIKey: VMJOFTHFJMLIKL-UHFFFAOYSA-N

• 2(3,5-Dihydroxy) Benzoic Acid
IUPAC Name: 3,5-dihydroxybenzoic acid | CAS Registry Number: 99-10-5
Synonyms: alpha-Resorcylic acid, 5-Carboxyresorcinol, 3,5-DIHYDROXYBENZOIC ACID, .alpha.-Resorcylic acid, Benzoic acid, 3,5-dihydroxy-, Ambap1483, 3,5-DIHYDROXYBENZOATE, D110000_ALDRICH, EINECS 202-730-7, NSC 22948, AIDS018063, AIDS-018063, NSC22948, BRN 2207864, AI3-52338, LS-143431, TL8006060, 4-10-00-01501 (Beilstein Handbook Reference), 34D, InChI=1/C7H6O4/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3,8-9H,(H,10,11

Molecular Formula: C7H6O4Molecular Weight: 154.120140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UYEMGAFJOZZIFP-UHFFFAOYSA-N

• 2,2-Dibromo-2-Cyanoacetamide
IUPAC Name: 2,2-dibromo-2-cyanoacetamide | CAS Registry Number: 10222-01-2
Synonyms: Dbnpa, Dibromocyanoacetamide, XD-7287l Antimicrobial, Caswell No. 287AA, NCIOpen2_006184, 2,2-Dibromo-3-nitrilopropionamide, 2,2-DIBROMO-2-CYANOACETAMIDE, Acetamide, 2,2-dibromo-2-cyano-, HSDB 6982, Dibromocyano acetic acid amide, 2,2-Dibromo-2-carbamoylacetonitrile, 540978_ALDRICH, Acetamide, 2-cyano-2,2-dibromo-, XD 7287L, EINECS 233-539-7, XD-1603, NSC 98283, EPA Pesticide Chemical Code 101801, CID25059, NSC98283

Molecular Formula: C3H2Br2N2OMolecular Weight: 241.868780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UUIVKBHZENILKB-UHFFFAOYSA-N

• 2,2-Dichlorodiethyl Ether
IUPAC Name: 1-chloro-2-(2-chloroethoxy)ethane | CAS Registry Number: 111-44-4
Synonyms: Dichloroether, Khloreks, Chlorex, Clorex, Chloroethyl ether, 2-Chloroethyl ether, Dichloroethyl ether, Dichloroethyl oxide, Ether dichlore, Bis(2-chloroethyl)ether, DCEE, Dicholoroethyl ether, sym-Dichloroethyl ether, BCEE, s-Dichloroethyl ether, 2,2'-Dichlorethyl ether, Caswell No. 309, Bis-2-chloroethylether, Di(2-chloroethyl) ether, BIS(2-CHLOROETHYL) ETHER

Molecular Formula: C4H8Cl2OMolecular Weight: 143.011720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZNSMNVMLTJELDZ-UHFFFAOYSA-N

• 2,2-Dimethyl Butyric Acid
IUPAC Name: 2,2-dimethylbutanoic acid | CAS Registry Number: 595-37-9
Synonyms: Neohexanoic acid, 2,2-Dimethylbutanoic acid, 2,2-Dimethyl butanoic acid, 2,2-DIMETHYLBUTYRIC ACID, Butyric acid, 2,2-dimethyl-, Butanoic acid, 2,2-dimethyl-, dimethyl ethyl acetic acid, 2,2-dimethyl-butanoic acid, MLS002174247, D152609_ALDRICH, alpha,alpha-Dimethylbutyric acid, alpha,alpha-Dimethylbutanoic acid, CHEBI:38649, NSC16045, EINECS 209-865-0, LMFA01020078, .alpha.,.alpha.-Dimethylbutyric acid, .alpha.,.alpha.-Dimethylbutanoic acid, NCGC00090948-01, SL-00458

Molecular Formula: C6H12O2Molecular Weight: 116.158280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VUAXHMVRKOTJKP-UHFFFAOYSA-N

• 2,3 Dichlorophenol
IUPAC Name: 2,3-dichlorophenol | CAS Registry Number: 576-24-9
Synonyms: 2,3-DICHLOROPHENOL, Phenol, 2,3-dichloro-, Phenol, dichloro-, DICHLOROPHENOL, Dichlorophenols, solid, Dichlorophenols, liquid, Ambap5765, CCRIS 5902, D69807_ALDRICH, HSDB 4264, 442291U_SUPELCO, EINECS 209-399-8, NSC 60646, NSC60646, BRN 2043615, EINECS 246-693-5, ZINC00388511, LS-1403, NCGC00091161-01, AI3-15332

Molecular Formula: C6H4Cl2OMolecular Weight: 163.001360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UMPSXRYVXUPCOS-UHFFFAOYSA-N

• 2,3,5-Trimethyl Hydroquinone
IUPAC Name: 2,3,5-trimethylbenzene-1,4-diol | CAS Registry Number: 700-13-0
Synonyms: Trimethylhydroquinone, Pseudocumohydroquinone, psi-Cumohydroquinone, .psi.-Cumohydroquinone, TMHYDROP, 2,3,5-Trimethylquinol, 2,3,5-Trimethylhydroquinone, 2,3,6-Trimethylhydroquinone, 1,4-Benzenediol, 2,3,5-trimethyl-, 3,6-Dihydroxypseudocumene, HYDROQUINONE, TRIMETHYL-, Trimethyhydroquinone polymer, 2,3,5-Trimethyl-1,4-benzenediol, T76503_ALDRICH, ARONIS003967, EINECS 211-838-3, AIDS220862, AIDS220869, NSC 401617, 2,3,5-trimethylbenzene-1,4-diol

Molecular Formula: C9H12O2Molecular Weight: 152.190380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: AUFZRCJENRSRLY-UHFFFAOYSA-N


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