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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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• 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

• 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

• 3-Chloroacetophenone
IUPAC Name: 1-(3-chlorophenyl)ethanone | CAS Registry Number: 99-02-5
Synonyms: 3'-Chloroacetophenone, omega-Chloroacetophenone, CHLOROACETOPHENONE, Ambap7200, Acetophenone, 3'-chloro-, Ethanone, 1-(3-chlorophenyl)-, 1-(3-Chlorophenyl)ethanone, CCRIS 638, 288799_ALDRICH, 22845_FLUKA, EINECS 202-721-8, ZINC02039606, Ethanone, 1-phenyl-, monochloro deriv, Ethanone, 1-phenyl-, monochloro deriv., LS-67567, InChI=1/C8H7ClO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H, 1341-24-8, 29731-15-5

Molecular Formula: C8H7ClOMolecular Weight: 154.593580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UUWJBXKHMMQDED-UHFFFAOYSA-N

• 2-Methyl-3-Acetoxybenzoic Acid
IUPAC Name: 3-acetyloxy-2-methylbenzoic acid | CAS Registry Number: 168899-58-9
Synonyms: 3-Acetoxy-2-methylbenzoic acid, 2-Methyl-3-acetoxybenzoic acid, 3-acetyloxy-2-methylbenzoic acid, SBB063332, AMBA, AC1MXZKZ, ACMC-209dz2, AC1Q1L9V, SureCN6178884, KSC495O2N, 495255_ALDRICH, Jsp003420, CTK3J5726, 3-Acetoxy-2-Methyl-Benzoic Acid, MolPort-001-794-616, AC-594, ANW-22380, 3-(Acetyloxy)-2-methyl-benzoic Acid, AKOS015888713, AB07799

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LHVJUPHCLWIPLZ-UHFFFAOYSA-N

• 3-Thiophenecarboxaldehyde
IUPAC Name: thiophene-3-carbaldehyde | CAS Registry Number: 498-62-4
Synonyms: 3-Formylthiophene, Thiophene-3-aldehyde, Thiophene-3-carbaldehyde, 3-Thiophenecarbaldehyde, Thiophene-3-carboxaldehyde, 3-Thienophenecarboxyaldehyde, 196282_ALDRICH, 88983_FLUKA, EINECS 207-865-5, NSC172858, SBB004320, ZINC00158756, NSC 172858, TL8003312, InChI=1/C5H4OS/c6-3-5-1-2-7-4-5/h1-4

Molecular Formula: C5H4OSMolecular Weight: 112.149660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: RBIGKSZIQCTIJF-UHFFFAOYSA-N

• 4-Aminobutyric Acid
IUPAC Name: 4-aminobutanoic acid | CAS Registry Number: 56-12-2
Synonyms: 4-Aminobutanoic acid, 4-aminobutyric acid, Piperidic acid, Gammalon, Piperidinic acid, GABA, Gammalone, Mielomade, Aminalon, Gaballon, Gammasol, Mielogen, Gamarex, Gammar, gamma-aminobutyric acid, Reanal, 4-aminobutyrate, 4-aminobutanoate, Gamastan, Gammagee

Molecular Formula: C4H9NO2Molecular Weight: 103.119760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BTCSSZJGUNDROE-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

• 2-Bromobenzoic Acid
IUPAC Name: 2-bromobenzoic acid | CAS Registry Number: 88-65-3
Synonyms: o-Bromobenzoic acid, 2-Bromobenzoate, Benzoic acid, 2-bromo-, 2-BROMOBENZOIC ACID, Benzoic acid, o-bromo-, Bromobenzoic acid, Benzoic acid, bromo-, 137677_ALDRICH, ARONIS008730, NSC 6976, 16320_FLUKA, EINECS 201-848-6, NSC6976, AIDS018021, AIDS-018021, BRN 0971266, AI3-03699, LS-36194, TL806152, ST5319443

Molecular Formula: C7H5BrO2Molecular Weight: 201.017400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XRXMNWGCKISMOH-UHFFFAOYSA-N

• 2'-Hydroxyacetophenone
IUPAC Name: 1-(2-hydroxyphenyl)ethanone | CAS Registry Number: 118-93-4
Synonyms: 2-Acetylphenol, o-Acetylphenol, Acetophenone, 2'-hydroxy-, O-HYDROXYACETOPHENONE, Acetophenone, o-hydroxy-, 1-(2-Hydroxyphenyl)ethanone, Ethanone, 1-(2-hydroxyphenyl)-, USAF KE-20, o-Hydroxyphenyl methyl ketone, 2-Hydroxyphenyl methyl ketone, Methyl 2-hydroxyphenyl ketone, FEMA No. 3548, WLN: QR BV1, H18607_ALDRICH, ACETOPHENONE,2-HYDROXY, W354805_ALDRICH, 54150_FLUKA, EINECS 204-288-0, NSC9263, NSC 16933

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

InChIKey: JECYUBVRTQDVAT-UHFFFAOYSA-N

• 5-Benzoylquinoline (CAS: 54-88-5)
• 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

• 3-(1-Cyanoethyl) Benzoic Acid (Ceba)
IUPAC Name: 3-(1-cyanoethyl)benzoic acid | CAS Registry Number: 5537-71-3
Synonyms: m-(1-Cyanoethyl)benzoic acid, 3-(1-Cyanoethyl)benzoic acid, 209805_ALDRICH, Benzoic acid, 3-(1-cyanoethyl)-, EINECS 226-897-0, NSC113992

Molecular Formula: C10H9NO2Molecular Weight: 175.183960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IRYIYPWRXROPSX-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-Bromotoluene
IUPAC Name: 1-bromo-4-methylbenzene | CAS Registry Number: 106-38-7
Synonyms: p-Bromotoluene, p-Tolyl bromide, Toluene, p-bromo-, Parabromotoluene, p-Methylbromobenzene, 1-Bromo-4-methylbenzene, 4-Tolyl bromide, 4-Methylbromobenzene, 4-BROMOTOLUENE, p-Methylphenyl bromide, Toluene, 4-bromo-, Benzene, 1-bromo-4-methyl-, 1-Methyl-4-bromobenzene, 4-Bromo-1-methylbenzene, 4-Methyl-1-bromobenzene, 4-Methylphenyl bromide, CCRIS 5983, B82200_ALDRICH, HSDB 6015, NSC 6531

Molecular Formula: C7H7BrMolecular Weight: 171.034480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZBTMRBYMKUEVEU-UHFFFAOYSA-N

• 2-Amino-5-Chloro Pyridine
IUPAC Name: 5-chloropyridin-2-amine | CAS Registry Number: 1072-98-6
Synonyms: 2-Amino-5-chloropyridine, 5-Chloro-2-pyridinamine, 2-Pyridinamine, 5-chloro-, 5-Chloro-2-pyridylamine, 5-Chloro-2-aminopyridine, A46803_ALDRICH, Pyridine, 2-amino-5-chloro-, 07530_FLUKA, AIDS021202, AIDS-021202, NSC26283, EINECS 214-020-4, SBB000059, A114, AI3-52448, TL800742115, AH-034/32826050, InChI=1/C5H5ClN2/c6-4-1-2-5(7)8-3-4/h1-3H,(H2,7,8

Molecular Formula: C5H5ClN2Molecular Weight: 128.559600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MAXBVGJEFDMHNV-UHFFFAOYSA-N

• 2-Methoxyphenyl acetonitrile
IUPAC Name: 2-(2-methoxyphenyl)acetonitrile | CAS Registry Number: 7035-03-2
Synonyms: (2-Methoxyphenyl)acetonitrile, Ambap1454, 2-Methoxybenzyl cyanide, (o-Methoxyphenyl)acetonitrile, 2-Methoxyphenylacetonitrile, 180645_ALDRICH, EINECS 230-314-5, ZINC00406907, AK-087/40365554, InChI=1/C9H9NO/c1-11-9-5-3-2-4-8(9)6-7-10/h2-5H,6H2,1H

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DWJKILXTMUGXOU-UHFFFAOYSA-N

• 2-Hydroxy-4-Methoxy Benzophenone
IUPAC Name: (2-hydroxy-4-methoxyphenyl)-phenylmethanone | CAS Registry Number: 131-57-7
Synonyms: oxybenzone, Oxybenzon, Benzophenone-3, Anuvex, Oxibenzonum, Solaquin, DuraScreen, Chimassorb 90, Uvinul 9, Advastab 45, Ongrostab HMB, Solbar, Syntase 62, Uvistat 24, Cyasorb UV 9, Sunscreen UV-15, Usaf cy-9, Mixture Name, Spectra-sorb UV 9, Uvinul M40

Molecular Formula: C14H12O3Molecular Weight: 228.243280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DXGLGDHPHMLXJC-UHFFFAOYSA-N

• 1,12-Dodecanediol
IUPAC Name: dodecane-1,12-diol | CAS Registry Number: 5675-51-4
Synonyms: Dodecamethylene glycol, Dodecane-1,12-diol, D221309_ALDRICH, 44040_FLUKA, 1,12-DIHYDROXY DODECANE, NSC81250, EINECS 227-133-9, ZINC01574339

Molecular Formula: C12H26O2Molecular Weight: 202.333640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GHLKSLMMWAKNBM-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

• 1,3-Di-N-Butylxanthine
IUPAC Name: 1,3-dibutyl-7H-purine-2,6-dione | CAS Registry Number: 2850-36-4
Synonyms: 1,3-Dibutylxanthine, CHEBI:288599, NSC515484, CID101421, ZINC12405693, 1,3-Dibutyl-3,7-dihydro-purine-2,6-dione, LT01148487, 1,3-Dibutyl-3,7-dihydro-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 1,3-dibutyl-3,7-dihydro-

Molecular Formula: C13H20N4O2Molecular Weight: 264.323500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HDAPVDGMACVEKL-UHFFFAOYSA-N

• 2-Chloro-4,5-Difluorobenzoic Acid
IUPAC Name: 2-chloro-4,5-difluorobenzoate | CAS Registry Number: 110877-64-0
Synonyms: ZINC00164784, CID6933326

Molecular Formula: C7H2ClF2O2-Molecular Weight: 191.539386 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: CGFMLBSNHNWJAW-UHFFFAOYSA-M

• 1,12-dodecanediamine
IUPAC Name: dodecane-1,12-diamine | CAS Registry Number: 2783-17-7
Synonyms: Dodecyldiamine, 1,12-Diaminododecane, Dodecamethylenediamine, 1,12-Diamindodecane, 1,12-DODECANEDIAMINE, 1,12-Dodecamethylenediamine, 1,12'-Dodecylenediamine, 1,12-Dodecylenediamine, 1,12'-Dodecamethylenediamine, D16401_ALDRICH, EINECS 220-489-6, NSC 55050, NSC 59861, NSC55050, NSC59861, BRN 1742765, LS-63440, 4-04-00-01376 (Beilstein Handbook Reference), 15536-18-2, 95931-03-6

Molecular Formula: C12H28N2Molecular Weight: 200.364120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QFTYSVGGYOXFRQ-UHFFFAOYSA-N

• 2-Methyl-3-Nitrobenzoic Acid
IUPAC Name: 2-methyl-3-nitrobenzoic acid | CAS Registry Number: 1975-50-4
Synonyms: 3-Nitro-o-toluic acid, 2-METHYL-3-NITROBENZOIC ACID, Benzoic acid, 2-methyl-3-nitro-, Oprea1_641068, 137847_ALDRICH, 3-Nitro-2-methyl benzoic acid, TPC-B005, TPC-I003, EINECS 217-826-4, CID16096, LS-976, NCGC00091604-01, ST5406632, M-4208, InChI=1/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11

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

InChIKey: YPQAFWHSMWWPLX-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

• 4-Hydroxy-2-butanone
IUPAC Name: 4-hydroxybutan-2-one | CAS Registry Number: 590-90-9
Synonyms: Methylolacetone, 3-Oxobutanol, Monomethylolacetone, 2-Butanone, 4-hydroxy-, 3-Oxo-1-butanol, 4-Butanol-2-one, 3-Ketobutan-1-ol, 4-Hydroxybutan-2-one, 3-hydroxy-2-butanone, Ambap2098, 1d7j, CH3C(O)CH2CH2OH, 2-Hydroxyethyl methyl ketone, ghl.PD_Mitscher_leg0.412, Ketones, C4-6, beta-hydroxy, 252557_ALDRICH, NSC41219, EINECS 209-693-6, CID111509, NSC 41219

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

InChIKey: LVSQXDHWDCMMRJ-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-Hydroxy-4-Octyloxybenzophenone
IUPAC Name: (2-hydroxy-4-octoxyphenyl)-phenylmethanone | CAS Registry Number: 1843-05-6
Synonyms: Octabenzone, Benzophenone-12, Benzon OO, Seikalizer E, Rhodialux P, Zislizer E, Benzophenone 12, Cyasorb UV 531, Chimassorb 81, UV Absorber HOB, Advastab 46, Sumisorb 130, Spectra-Sorb UV 531, Anti-UV P, Biosorb 130, Carstab 700, Viosorb 130, Sanduvor 3035, Aduvex 248, Uvinul 408

Molecular Formula: C21H26O3Molecular Weight: 326.429340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QUAMTGJKVDWJEQ-UHFFFAOYSA-N

• 3-Bromo-5-chlorosalicylaldehyde
IUPAC Name: 3-bromo-5-chloro-2-hydroxybenzaldehyde | CAS Registry Number: 19652-32-5
Synonyms: 497592_ALDRICH, ZINC00122906, 3-Bromo-5-chloro-2-hydroxybenzaldehyde, CID519676, A0927/0043385

Molecular Formula: C7H4BrClO2Molecular Weight: 235.462460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: KNOYZLVIXXBBIB-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

• 4-Hydroxybenzoic Acid
IUPAC Name: 4-hydroxybenzoic acid | CAS Registry Number: 99-96-7
Synonyms: p-Hydroxybenzoic acid, 4-Carboxyphenol, p-Salicylic acid, 4-HYDROXYBENZOIC ACID, p-hydroxybenzoate, Paraben, 4-hydroxybenzoate, Benzoic acid, 4-hydroxy-, Benzoic acid, p-hydroxy-, 3pcc, 3pch, 4-Hydroxybenzoesaeure, Hydroxybenzoic acid, phenol derivative, 8, p-Oxybenzoesaure [German], Benzoic acid, p-hydroxy, Benzoic acid, 4-hydroxy, WLN: QVR DQ, CID135, Hydroxybenzenecarboxylic acid

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: FJKROLUGYXJWQN-UHFFFAOYSA-N

• 3-Hydroxybenzoic Acid
IUPAC Name: 3-hydroxybenzoic acid | CAS Registry Number: 99-06-9
Synonyms: 3-Hydroxybenzoic acid, 3-Carboxyphenol, m-Salicylic acid, M-HYDROXYBENZOIC ACID, m-Hba, Benzoic acid, 3-hydroxy-, Benzoic acid, m-hydroxy-, 3-Hydroxybenzoate, 3pcb, Enamine_005356, H20008_ALDRICH, Acido m-idrossibenzoico [Italian], Kyselina 3-hydroxybenzoova [Czech], 54610_FLUKA, 54620_FLUKA, CHEBI:30764, EINECS 202-726-5, NSC 55746, AIDS018037, AIDS-018037

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IJFXRHURBJZNAO-UHFFFAOYSA-N

• 4-Methoxyphenylboronic Acid
IUPAC Name: (4-methoxyphenyl)boronic acid | CAS Registry Number: 5720-07-0
Synonyms: p-Anisylboronic acid, 4-Methoxyphenylboronic acid, 4-Methoxybenzeneboronic acid, p-Methoxyphenylboronic acid, p-Methoxybenzeneboronic acid, Phenylboronic Acid, 12, (4-Methoxyphenyl)boronic acid, Boronic acid, p-methoxyphenyl-, Benzeneboronic acid, p-methoxy-, 417599_ALDRICH, 65168_FLUKA, BM172, ALBB-006094, BRN 2936912, SBB004055, AI3-61385, NCGC00092016-01, LS-29185, Boronic acid, (4-methoxyphenyl)- (9CI), TL8003683

Molecular Formula: C7H9BO3Molecular Weight: 151.955560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VOAAEKKFGLPLLU-UHFFFAOYSA-N

• 4-Amino-6-Chloro-5-Methoxypyrimidine
IUPAC Name: 6-chloro-5-methoxypyrimidin-4-amine | CAS Registry Number: 5018-41-7
Synonyms: EINECS 225-700-5, CID78721, 6-Chloro-5-methoxypyrimidin-4-amine

Molecular Formula: C5H6ClN3OMolecular Weight: 159.573640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: AAJZJNHQPBMCFV-UHFFFAOYSA-N

• 4-Nitroindole
IUPAC Name: 4-nitro-1H-indole | CAS Registry Number: 4769-97-5
Synonyms: Indole, 4-nitro-, 4-Nitro-1H-indole, 1H-Indole, 4-nitro-, Maybridge1_006408, Oprea1_676916, 269964_ALDRICH, ZINC00082985, ST5406370, TL8003237, N-2980

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

InChIKey: LAVZKLJDKGRZJG-UHFFFAOYSA-N

• 3 4-Dihydroxybenzoic Acid
IUPAC Name: 3,4-dihydroxybenzoic acid | CAS Registry Number: 99-50-3
Synonyms: protocatechuic acid, protocatechuate, Protocatehuic acid, 3,4-DIHYDROXYBENZOIC ACID, 1ykp, 3,4-dihydroxybenzoate, 4,5-Dihydroxybenzoic acid, Benzoic acid, 3,4-dihydroxy-, 4-Carboxy-1,2-dihydroxybenzene, 3,4-dihydrobenzoic acid, Protocatechuic acid polymer, CCRIS 6291, 3, 4-Dihydroxybenzoic acid, CID72, MLS000737807, 3-4-DIHYDROXYBENZOATE, C7H6O4, 37580_FLUKA, CHEBI:36062, EINECS 202-760-0

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

InChIKey: YQUVCSBJEUQKSH-UHFFFAOYSA-N

• 1,8-Dichlorooctane
IUPAC Name: 1,8-dichlorooctane | CAS Registry Number: 2162-99-4
Synonyms: Octane, 1,8-dichloro-, 361283_ALDRICH, EINECS 218-490-1, SBB008751

Molecular Formula: C8H16Cl2Molecular Weight: 183.118640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WXYMNDFVLNUAIA-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

• 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

• 4,4-Diamino Diphenyl Sulphone
IUPAC Name: 4-(4-aminophenyl)sulfonylaniline | CAS Registry Number: 80-08-0
Synonyms: dapsone, Diaphenylsulfone, Disulone, Dapson, Diaphenylsulfon, Avlosulfone, Diphenasone, Sulfadione, Sulfona, Aczone, Udolac, Metabolite C, Sulfonyldianiline, Croysulfone, Sulphadione, Acedapsone, Avlosulfon, Novophone, Dapsonum, Dumitone

Molecular Formula: C12H12N2O2SMolecular Weight: 248.300880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MQJKPEGWNLWLTK-UHFFFAOYSA-N

• 2-Methyl-6-nitrobenzoic acid
IUPAC Name: 2-methyl-6-nitrobenzoic acid | CAS Registry Number: 13506-76-8
Synonyms: 6-Nitro-o-toluic acid, 2-METHYL-6-NITROBENZOIC ACID, Ambap4624, 5-Nitro-o-toluic acid, o-Toluic acid, 6-nitro-, 6-Methyl-2-nitrobenzoic acid, MLS002152875, 151394_ALDRICH, Benzoic acid, 2-methyl-6-nitro-, EINECS 236-833-3, CID16097, EINECS 217-829-0, LS-789, NCGC00091581-01, 2-METHYL-5-NITROBENZOIC ACID, SMR001224490, ST5406588, InChI=1/C8H7NO4/c1-5-3-2-4-6(9(12)13)7(5)8(10)11/h2-4H,1H3,(H,10,11, 1975-52-6, 27329-28-8

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

InChIKey: CCXSGQZMYLXTOI-UHFFFAOYSA-N

• 2-Chloro-1,4-diaminobenzene Sulphate
IUPAC Name: 2-chlorobenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 61702-44-1
Synonyms: Fourrine SO, renal brown so, Renal SO, Fourrine 81, 2-Cl-p-PD, C.I. Oxidation Base 13A, CCRIS 145, 2-Chloro-p-phenylenediamine sulfate, 3-Chloro-4-aminoaniline sulfate, HSDB 6247, NCI-C03316, 2-Chloro-p-phenylenediamine SO4, 24240_FLUKA, EINECS 228-291-1, EINECS 262-915-3, 2-Chloro p-phenylenediamine sulphate, 2-chlorobenzene-1,4-diamine sulfate, 2-Chloro-1,4-phenylenediamine sulfate, CID22584, p-Phenylenediamine, 2-chloro-, sulfate

Molecular Formula: C6H9ClN2O4SMolecular Weight: 240.664660 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: GQFGHCRXPLROOF-UHFFFAOYSA-N

• 1,3,5-Cyclohexanetriol
IUPAC Name: cyclohexane-1,3,5-triol | CAS Registry Number: 2041-15-8
Synonyms: Phloroglucitol, cis-Cyclohexane-1,3,5-Triol, NSC25143, LTBB004677, CID230351, ZINC00388461, TL8001693, 1,3,5-Cyclohexanetriol, (1.alpha.,3.alpha.,5.alpha.)-, InChI=1/C6H12O3/c7-4-1-5(8)3-6(9)2-4/h4-9H,1-3H, 6099-90-7

Molecular Formula: C6H12O3Molecular Weight: 132.157680 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: FSDSKERRNURGGO-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

• 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

• 2',6'-Dimethoxyacetophenone
IUPAC Name: 1-(2,6-dimethoxyphenyl)ethanone | CAS Registry Number: 2040-04-2
Synonyms: 2,6-Dimethoxyacetophenone, 1-(2,6-DIMETHOXYPHENYL)ETHANONE, USAF K-2801, Acetophenone, 2',6'-dimethoxy-, 300748_ALDRICH, AIDS017985, EINECS 218-034-1, 1-(2,6-Dimethoxyphenyl)ethan-1-one, AIDS-017985, ALBB-006380, CID16267, BRN 2048976, ZINC00330167, Ethanone, 1-(2,6-dimethoxyphenyl)-, LS-13510, ST5331350, Ethanone, 1-(2,6-dimethoxyphenyl)- (9CI), 4-08-00-01811 (Beilstein Handbook Reference), AB-131/40897142

Molecular Formula: C10H12O3Molecular Weight: 180.200480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XEUGKOFTNAYMMX-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

• 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

• 3-Phenoxyaniline
IUPAC Name: 3-(phenoxy)aniline | CAS Registry Number: 3586-12-7
Synonyms: m-Phenoxyaniline, Benzenamine, 3-phenoxy-, Aniline, m-phenoxy-, 3-Aminodiphenyl ether, m-Aminophenyl phenyl ether, 3-Aminophenyl phenyl ether, 338354_ALDRICH, NSC57083, EINECS 222-715-9, NSC 57083, ZINC00389600, ST5407020

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

InChIKey: UCSYVYFGMFODMY-UHFFFAOYSA-N

• 8 Chloro Theophylline
IUPAC Name: 8-chloro-1,3-dimethyl-7H-purine-2,6-dione | CAS Registry Number: 85-18-7
Synonyms: 8-Chlorotheophylline, Theophylline, 8-chloro-, 1,3-Dimethyl-8-chloroxanthine, Oprea1_038673, Oprea1_741931, C71807_ALDRICH, NSC 6113, EINECS 201-590-4, NSC6113, SBB003404, ZINC00039568, LS-149440, 1H-Purine-2,6-dione, 8-chloro-3,7-dihydro-1,3-dimethyl-, 8-Chloro-1,3-dimethyl-2,6(1H,3H)-purinedione, AF-407/34872033, 8-Chloro-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione, 8-chloro-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione, 1H-Purine-2,6-dione, 8-chloro-3,7-dihydro-1,3-dimethyl- (9CI), H33

Molecular Formula: C7H7ClN4O2Molecular Weight: 214.609080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RYIGNEOBDRVTHA-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


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