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• 2-(3-Benzoylphenyl)propionitrile
IUPAC Name: 2-[3-(benzoyl)phenyl]propanenitrile | CAS Registry Number: 42872-30-0
Synonyms: 2-(m-Benzoylphenyl)propionitrile, 196347_ALDRICH, EINECS 255-982-5, BRN 2844731, LS-29023, 24336 R.P, TL8007037, 24336 R.P., BENZENEACETONITRILE, 3-BENZOYL-alpha-METHYL-, Benzeneacetonitrile, 3-benzoyl-.alpha.-methyl-

Molecular Formula: C16H13NOMolecular Weight: 235.280520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RGYOCHMZSLUCNP-UHFFFAOYSA-N

• 2,3-Pyrazinedicarboxylic anhydride
IUPAC Name: furo[3,4-b]pyrazine-5,7-dione | CAS Registry Number: 4744-50-7
Synonyms: Furo[3,4-b]pyrazine-5,7-dione, 405019_ALDRICH, 2,3-Pyrazinecarboxylic anhydride, ZERO/005276, AIDS189631, Furo(3,4-b)pyrazine-5,7-dione, AIDS-189631, EINECS 225-260-4, FS000874, EC-000.1366, 2,3-Pyrazinedicarboxylic anhydride treated BSA, 2,3-Pyrazinedicarboxylic anhydride treated bovine serum albumin

Molecular Formula: C6H2N2O3Molecular Weight: 150.091680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: AWJWCTOOIBYHON-UHFFFAOYSA-N

• 4-Amino-5-methoxy-2-methyl-N-methylbenzenesulfonamide
IUPAC Name: 4-amino-5-methoxy-N,2-dimethylbenzenesulfonamide | CAS Registry Number: 49564-57-0
Synonyms: EINECS 256-380-5, TL8003297, N,2-Dimethyl-4-amino-5-methoxybenzenesulfonamide, 4-Amino-5-methoxy-N,2-dimethylbenzenesulphonamide, 4-Amino-5-methoxy-2-methylbenzenesulfon-N-methylamide, Benzenesulfonamide, 4-amino-5-methoxy-N,2-dimethyl-, 79116-56-6

Molecular Formula: C9H14N2O3SMolecular Weight: 230.284060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GWSQAGVGSHXRJK-UHFFFAOYSA-N

• 1,2-Naphthoquinone
IUPAC Name: naphthalene-1,2-dione | CAS Registry Number: 524-42-5
Synonyms: o-Naphthoquinone, 1,2-Naphthalenedione, 1,2-NAPHTHOQUINONE, beta-Naphthoquinone, 1,2-Naphthaquinone, .beta.-Naphthoquinone, ortho-naphthoquinone, 1,2-Naftochinon [Czech], CCRIS 1558, WLN: L66 BVVJ, HSDB 2036, MLS000069467, 346616_ALDRICH, 1,2-Dione-Based Compound, 8, NSC 9831, EINECS 208-360-2, C10H6O2, NSC9831, 1,2-Dihydro-1,2-diketo-naphthalene, AIDS017889

Molecular Formula: C10H6O2Molecular Weight: 158.153440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KETQAJRQOHHATG-UHFFFAOYSA-N

• 1-Naphthalenethiol
IUPAC Name: naphthalene-1-thiol | CAS Registry Number: 529-36-2
Synonyms: .alpha.-Naphthyl mercaptan, CID68259, EINECS 208-462-7, AI3-14854

Molecular Formula: C10H8SMolecular Weight: 160.235520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: SEXOVMIIVBKGGM-UHFFFAOYSA-N

• 1,2,3,4-Tetrafluorobenzene
IUPAC Name: 1,2,3,4-tetrafluorobenzene | CAS Registry Number: 551-62-2
Synonyms: TETRAFLUOROBENZENE, 1,2,3,4-TETRAFLUOROBENZENE, Benzene, 1,2,3,4-tetrafluoro-, T11630_ALDRICH, 2,3,4,5-Tetrafluorobenzene, NSC21635, EINECS 208-997-6, EINECS 248-779-8, TL8003603, 28016-01-5

Molecular Formula: C6H2F4Molecular Weight: 150.073693 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SOZFIIXUNAKEJP-UHFFFAOYSA-N

• 2-Aminotoluene-4-sulfonic acid
IUPAC Name: 3-amino-4-methylbenzenesulfonic acid | CAS Registry Number: 618-03-1
Synonyms: 3-Amino-p-toluenesulfonic acid, 2-Amino-4-toluenesulfonic acid, NSC7922, p-Toluenesulfonic acid, 3-amino-, 2-Aminotoluene-4-sulphonic acid, 3-Amino-4-methylbenzenesulfonic acid, CID69246, NSC 7922, EINECS 210-540-0, 1-Amino-2-methyl-5-benzenesulfonic acid, Benzenesulfonic acid, 3-amino-4-methyl-, 3-Amino-4-methyl-benzenesulfonic acid, BAS 00531520, ST5233538

Molecular Formula: C7H9NO3SMolecular Weight: 187.216260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DTNODBHGOLWROS-UHFFFAOYSA-N

• 1-Indolepropionic acid
IUPAC Name: 3-indol-1-ylpropanoic acid | CAS Registry Number: 6639-06-1
Synonyms: Indole-1-propionic acid, 1H-Indole-1-propionic acid, NSC17814, 3-(1H-indol-1-yl)propanoic acid, ALBB-009256, CID81139, EINECS 229-643-7, ST5444546

Molecular Formula: C11H11NO2Molecular Weight: 189.210540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OSWNOVFZARRSKM-UHFFFAOYSA-N

• (R)-(+) 4-Bromotetramisole oxalate
IUPAC Name: (6R)-6-(4-bromophenyl)-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole | CAS Registry Number: 71461-24-0
Synonyms: S(-)-p-Bromotetramisole oxalate, ZINC00056496, NCGC00162046-01

Molecular Formula: C11H11BrN2SMolecular Weight: 283.187440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HTHGAIADRJRJOY-JTQLQIEISA-N

• (s)-(+)-2-(Benzyloxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
IUPAC Name: (3S)-2-(phenylmethoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate | CAS Registry Number: 79261-58-8
Synonyms: ZINC00057069, CID6921671

Molecular Formula: C18H16NO4-Molecular Weight: 310.323940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YWVQGUBCAUFBCP-INIZCTEOSA-M

• 2-Amino-N-ethyl-N-phenyl-benzenesulfonamide
IUPAC Name: 2-amino-N-ethyl-N-phenylbenzenesulfonamide | CAS Registry Number: 81-10-7
Synonyms: 562947_ALDRICH, 2-Amino-N-ethylbenzenesulfonanilide, NSC81263, 2-Amino-N-ethylbenzenesulphonanilide, EINECS 201-324-7, NSC 81263, N-Ethyl-N-phenyl-o-aminobenzenesulfonamide, Benzenesulfonanilide, 2-amino-N-ethyl-, Benzenesulfonanilide, 2-amino-n-ethyl-,, 2-Amino-N-ethyl-N-phenylbenzenesulfonamide, Benzenesulfonamide, 2-amino-N-ethyl-N-phenyl-, 2-Aminobenzene-N-ethyl-N-phenyl sulfonamide, ST5409344, Benzenesulfonanilide, 2-amino-N-ethyl- (8CI)

Molecular Formula: C14H16N2O2SMolecular Weight: 276.354040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OXZNTECZWGFYMM-UHFFFAOYSA-N

• 2-Cyanopyrimidine
IUPAC Name: pyrimidine-2-carbonitrile | CAS Registry Number: 14080-23-0
Synonyms: pyrimidine-2-carbonitrile, 2-Pyrimidinecarbonitrile, AG-D-81557, F2173-0037, 2-cyano-pyrimidine, 2-Cyano pyrimidine, Pyrimidinecarbonitrile, ZINC02531032, zlchem 283, PubChem7042, 2CPM, ACMC-1BOY6, AGN-PC-0D4UNG, SureCN151679, AC1MBX40, SureCN2643396, 2-CPY, KSC138C0F, 646830_ALDRICH, AC1Q4R59

Molecular Formula: C5H3N3Molecular Weight: 105.097420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IIHQNAXFIODVDU-UHFFFAOYSA-N

• (2r)-2-Piperazine Carboxylic Acid
• 2-Bromo-1,3,5-trifluorobenzene
IUPAC Name: 2-bromo-1,3,5-trifluorobenzene | CAS Registry Number: 2367-76-2
Synonyms: 1-Bromo-2,4,6-trifluorobenzene, 2,4,6-Trifluorobromobenzene, 247987_ALDRICH, Benzene, 2-bromo-1,3,5-trifluoro-, CID75398, EINECS 219-125-9, TE3097, ST5408595, TL8001955, InChI=1/C6H2BrF3/c7-6-4(9)1-3(8)2-5(6)10/h1-2

Molecular Formula: C6H2BrF3Molecular Weight: 210.979290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PZBSPSOGEVCRQI-UHFFFAOYSA-N

• 2-Methoxy-3-ethylpyrazine
IUPAC Name: 2-ethyl-3-methoxypyrazine | CAS Registry Number: 25680-58-4
Synonyms: 2-ETHYL-3-METHOXYPYRAZINE, Pyrazine, 2-ethyl-3-methoxy-, W514403_ALDRICH, 293806_ALDRICH, EINECS 247-184-0, ZINC00409299, InChI=1/C7H10N2O/c1-3-6-7(10-2)9-5-4-8-6/h4-5H,3H2,1-2H

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DPCILIMHENXHQX-UHFFFAOYSA-N

• 2-(2-Hydroxy-5-tert-octylphenyl)benzotriazole
IUPAC Name: 2-(benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol | CAS Registry Number: 3147-75-9
Synonyms: OCTRIZOLE, UV Absorber-5, Sumisorb 340, Seesorb 709, Tinuvin 329, Viosorb 583, Cyasorb 5411, Cyasorb UV 5411, Octrizole [USAN:INN], Octrizol [INN-Spanish], Octrizolum [INN-Latin], Spectra-Sorb UV 5411, Octrizole (USAN/INN), Oprea1_301042, 322806_ALDRICH, 2-Benzotriazolyl-4-tert-octylphenol, EINECS 221-573-5, ZINC01849911, 2-(2-Hydroxy-5-t-octylphenyl)benzotriazole, 2-(5-t-Octyl-2-hydroxyphenyl)benzotriazole

Molecular Formula: C20H25N3OMolecular Weight: 323.432000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IYAZLDLPUNDVAG-UHFFFAOYSA-N

• 5-Bromo-2-fluorotoluene
IUPAC Name: 4-bromo-1-fluoro-2-methylbenzene | CAS Registry Number: 51437-00-4
Synonyms: 283495_ALDRICH, 17105_FLUKA, Benzene, 4-bromo-1-fluoro-2-methyl-, EINECS 257-202-9, ST5405489, TL8003405, InChI=1/C7H6BrF/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H

Molecular Formula: C7H6BrFMolecular Weight: 189.024943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VXKYOKPNAXNAFU-UHFFFAOYSA-N

• 2-Bromo-4-Fluoroaniline
IUPAC Name: 2-bromo-4-fluoroaniline | CAS Registry Number: 1003-98-1
Synonyms: 2-Bromo-4-fluoroaniline, 2-Bromo-4-fluorobenzenamine, 369055_ALDRICH, NSC51870, CID242873, ZINC00159787, ST5408548, TL8000048

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YLMFXCIATJJKQL-UHFFFAOYSA-N

• 2-Bromo-4-NitroToluene
IUPAC Name: 2-bromo-1-methyl-4-nitrobenzene | CAS Registry Number: 7745-93-9
Synonyms: 2-Bromo-4-nitrotoluene, B74402_ALDRICH, Toluene, 2-bromo-4-nitro-, 1-Bromo-2-methyl-5-nitrobenzene, 2-Bromo-1-methyl-4-nitrobenzene, Benzene, 2-bromo-1-methyl-4-nitro-, EINECS 231-809-9, NSC402166, SBB007843, ZINC01081254, FR-0441, TL80073548, AE-641/04636041

Molecular Formula: C7H6BrNO2Molecular Weight: 216.032040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XFZFJQHXWJIBQV-UHFFFAOYSA-N

• 2-Chloro-5-Nitro Benzoyl Chloride
IUPAC Name: 2-chloro-5-nitrobenzoyl chloride | CAS Registry Number: 25784-91-2
Synonyms: 2-Chloro-5-nitrobenzoyl chloride, Benzoyl chloride, 2-chloro-5-nitro-, ZINC02522758, EINECS 247-262-4, CID117637, InChI=1/C7H3Cl2NO3/c8-6-2-1-4(10(12)13)3-5(6)7(9)11/h1-3

Molecular Formula: C7H3Cl2NO3Molecular Weight: 220.009620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OGLKKYALUKXVPQ-UHFFFAOYSA-N

• 2-Cyanomethyl Benzimidazole
IUPAC Name: 2-(1H-benzimidazol-2-yl)acetonitrile | CAS Registry Number: 4414-88-4
Synonyms: 2-Benzimidazolylacetonitrile, 2-Cyanomethylbenzimidazole, 2-Kyanmethylbenzimidazol, 1H-Benzimidazole-2-acetonitrile, Enamine_003017, Benzimidazole, 2-cyanomethyl-, Acetonitrile, 2-benzimidazolyl-, (2-Benzimidazolyl)acetonitrile, 2-BENZIMIDAZOLEACETONITRILE, B5291_ALDRICH, 2-(Cyanomethyl)benzimidazole, Oprea1_467984, (Benzimidazol-2-yl)ethanenitrile, 2-Kyanmethylbenzimidazol [Czech], ARONIS020221, 12263_FLUKA, EINECS 224-574-9, ZERO/005566, 1H-Benzimidazol-2-ylacetonitrile, WLN: T56 BM DNJ C1CN

Molecular Formula: C9H7N3Molecular Weight: 157.171980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BWOVACANEIVHST-UHFFFAOYSA-N

• 2-Fluoro Benzaldehyde
IUPAC Name: 2-fluorobenzaldehyde | CAS Registry Number: 446-52-6
Synonyms: 2-Fluorobenzaldehyde, o-Fluorobenzaldehyde, Benzaldehyde, 2-fluoro-, Benzaldehyde, o-fluoro-, F4807_ALDRICH, Benzaldehyde, o-fluoro- (8CI), EINECS 207-171-2, NSC 66829, NSC66829, BRN 0507155, ZINC00157161, LS-25048, ST5213339, 4-07-00-00559 (Beilstein Handbook Reference), InChI=1/C7H5FO/c8-7-4-2-1-3-6(7)5-9/h1-5

Molecular Formula: C7H5FOMolecular Weight: 124.112403 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZWDVQMVZZYIAHO-UHFFFAOYSA-N

• 2-Methoxy-5-sulfamoylbenzoic acid
IUPAC Name: 2-methoxy-5-sulfamoylbenzoic acid | CAS Registry Number: 22117-85-7
Synonyms: 5-Sulphamoyl-o-anisic acid, EINECS 244-789-1, ST5407390

Molecular Formula: C8H9NO5SMolecular Weight: 231.225760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: SQAILWDRVDGLGY-UHFFFAOYSA-N

• 2-Amino Anthraquinone
IUPAC Name: 2-aminoanthracene-9,10-dione | CAS Registry Number: 117-79-3
Synonyms: 2-AMINOANTHRAQUINONE, Aminoanthraquinone, Anthraquinone, 2-amino-, beta-Anthraquinonylamine, beta-Aminoanthraquinone, 2-Amino-9,10-anthraquinone, 9,10-Anthracenedione, 2-amino-, CCRIS 23, NSC5, .beta.-Aminoanthraquinone, NSC 5, 2-Amino-9,10-anthracenedione, CBMicro_011266, 2-Aminoanthra-9,10-quinone, 2-AAQ, NCI-C01876, HSDB 4088, MLS002152869, 165549_ALDRICH, EINECS 204-208-4

Molecular Formula: C14H9NO2Molecular Weight: 223.226760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XOGPDSATLSAZEK-UHFFFAOYSA-N

• 2-Amino-3,5-Dichloropyridine
IUPAC Name: 3,5-dichloropyridin-2-amine | CAS Registry Number: 4214-74-8
Synonyms: 2-Amino-3,5-dichloropyridine, 2-Pyridinamine, 3,5-dichloro-, 3,5-Dichloro-3-pyridylamine, 3,5-Dichloro-2-aminopyridine, 135925_ALDRICH, 3,5-dichloropyridin-2-ylamine, Pyridine, 2-amino-3,5-dichloro-, NSC51586, EINECS 224-143-5, SBB003932, A177, AC-907/25014045, InChI=1/C5H4Cl2N2/c6-3-1-4(7)5(8)9-2-3/h1-2H,(H2,8,9

Molecular Formula: C5H4Cl2N2Molecular Weight: 163.004660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OCWBGKZFOYMCCN-UHFFFAOYSA-N

• 2-Amino-6-Chloro Benzothiazole
IUPAC Name: 6-chloro-1,3-benzothiazol-2-amine | CAS Registry Number: 95-24-9
Synonyms: 2-Amino-6-chlorobenzothiazole, 2-Benzothiazolamine, 6-chloro-, Maybridge1_001187, 6-Chlorobenzothiazol-2-ylamine, MLS001005225, 136085_ALDRICH, EINECS 202-402-3, BRN 0127752, SBB000249, ZINC00119437, BENZOTHIAZOLE, 2-AMINO-6-CHLORO-, LS-40664, SMR000348635, 4-27-00-04862 (Beilstein Handbook Reference), SR-01000641019-1, InChI=1/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10

Molecular Formula: C7H5ClN2SMolecular Weight: 184.646000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VMNXKIDUTPOHPO-UHFFFAOYSA-N

• 2-Chloropropionyl Chloride
IUPAC Name: 2-chloropropanoyl chloride | CAS Registry Number: 7623-09-8
Synonyms: 2-Chloropropionyl chloride, .alpha.-Chloropropionyl chloride, Propanoyl chloride, 2-chloro-, 157139_ALDRICH, 26200_FLUKA, EINECS 231-540-7, 76248-57-2

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

InChIKey: JEQDSBVHLKBEIZ-UHFFFAOYSA-N

• 2,6-Dichlorobenzyl Cyanide
IUPAC Name: 2-(2,6-dichlorophenyl)acetonitrile | CAS Registry Number: 3215-64-3
Synonyms: 2,6-Dichlorobenzyl cyanide, (2,6-Dichlorophenyl)acetonitrile, NCIOpen2_000517, 2,6-Dichlorophenylacetonitrile, 126012_ALDRICH, 2,6-Dichlorobenzeneacetonitrile, Acetonitrile, (2,6-dichlorophenyl)-, NSC72901, Benzeneacetonitrile, 2,6-dichloro-, CID76678, EINECS 221-730-8, ZINC00388165, ST5406205

Molecular Formula: C8H5Cl2NMolecular Weight: 186.038000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AOEJUUCUKRUCEF-UHFFFAOYSA-N

• 2,6-Dichlorofluorobenzene
IUPAC Name: 1,3-dichloro-2-fluorobenzene | CAS Registry Number: 2268-05-5
Synonyms: 1,3-Dichloro-2-fluorobenzene, 323918_ALDRICH, CID137520, ST5405437, InChI=1/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3

Molecular Formula: C6H3Cl2FMolecular Weight: 164.992423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: JORVCRLRRRRLFI-UHFFFAOYSA-N

• 2,6-Dihydroxy Acetophenone
IUPAC Name: 1-(2,6-dihydroxyphenyl)ethanone | CAS Registry Number: 699-83-2
Synonyms: 2-Acetylresorcinol, 2',6'-Dihydroxyacetophenone, 2,6-Dihydroxyacetophenone, gamma-Resacetophenone, Resorcinol, 2-acetyl-, .gamma.-Resacetophenone, 1,3-Benzenediol, 2-acetyl-, D107808_ALDRICH, 1-(2,6-Dihydroxyphenyl)ethanone, 2-Acetyl-1,3-dihydroxybenzene, NSC615, 37468_FLUKA, NSC 615, Acetophenone, 2',6'-dihydroxy-, EINECS 211-833-6, ZINC00157768, Ethanone, 1-(2,6-dihydroxyphenyl)-, LS-3428, NCGC00166008-01, Acetophenone, 2',6'-dihydroxy- (8CI)

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

InChIKey: YPTJKHVBDCRKNF-UHFFFAOYSA-N

• 2-Acetyl Phenothiazine
IUPAC Name: 1-(10H-phenothiazin-2-yl)ethanone | CAS Registry Number: 6631-94-3
Synonyms: 2-Acetylphenothiazine, 3-Acetylphenothiazine, MLS000047624, 1-(10H-Phenothiazin-2-yl)ethanone, Methyl phenothiazin-2-yl ketone, Ethanone, 1-(10H-phenothiazin-2-yl)-, NSC57951, EINECS 229-626-4, NSC169669, STK301831, ZINC00119687, SMR000033635, AK-968/41128722, SR-01000597201-3, InChI=1/C14H11NOS/c1-9(16)10-6-7-14-12(8-10)15-11-4-2-3-5-13(11)17-14/h2-8,15H,1H

Molecular Formula: C14H11NOSMolecular Weight: 241.308240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JWGBOHJGWOPYCL-UHFFFAOYSA-N

• 2-Bromo-3-methylbutyric acid
IUPAC Name: 2-bromo-3-methylbutanoic acid | CAS Registry Number: 565-74-2
Synonyms: 2-Bromoisovaleric acid, alpha-Bromoisovaleric acid, 2-Bromo-3-methylbutanoic acid, Butyric acid, 2-bromo-3-methyl-, Butanoic acid, 2-bromo-3-methyl-, .alpha.-Bromoisovaleric acid, NSC 167, 251003_ALDRICH, NSC167, 17460_FLUKA, EINECS 209-291-0, NSC6967, BB_SC-0176, BRN 1721146, AI3-21065, 2-BROMO-3-METHYL-BUTANOIC ACID, LS-47883, (+/-)-2-BROMO-3-METHYLBUTYRIC ACID, Butanoic acid, 2-bromo-3-methyl-, (.+/-.)-, InChI=1/C5H9BrO2/c1-3(2)4(6)5(7)8/h3-4H,1-2H3,(H,7,8

Molecular Formula: C5H9BrO2Molecular Weight: 181.027760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UEBARDWJXBGYEJ-UHFFFAOYSA-N

• (S)-3-Chloro-1,2-propanediol
IUPAC Name: (2S)-3-chloropropane-1,2-diol | CAS Registry Number: 60827-45-4
Synonyms: alpha-Chlorohydrin, (S)-alpha-Chlorohydrin, sGPhMQDIK]UQX@, S-3-Chloro-1,2-propanediol, 3-Chloropropane-1,2-diol, CCRIS 7386, 1,2-Propanediol, 3-chloro-, 540064_ALDRICH, (S)-alpha-Glycerol chlorohydrin, 26077_FLUKA, 1,2-Propanediol, 3-chloro-, (S)-, ZINC02041174, (S)-()-3-Chloro-1,2-propanediol, (S)-(+)-3-Chloro-1,2-propanediol, LS-120253, TL8003855, InChI=1/C3H7ClO2/c4-1-3(6)2-5/h3,5-6H,1-2H, 96-24-2

Molecular Formula: C3H7ClO2Molecular Weight: 110.539480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SSZWWUDQMAHNAQ-GSVOUGTGSA-N

• 2,4-Dimethoxy-6-chloropyrimidine
IUPAC Name: 4-chloro-2,6-dimethoxypyrimidine | CAS Registry Number: 6320-15-6
Synonyms: C36408_ALDRICH, 6-Chloro-2,4-dimethoxypyrimidine, NSC31796, 4-Chloro-2,6-dimethoxypyrimidine, CID80600, EINECS 228-669-6, ZINC00399489, Pyrimidine, 4-chloro-2,6-dimethoxy-, ST5410866

Molecular Formula: C6H7ClN2O2Molecular Weight: 174.584980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JHNRTJRDRWKAIW-UHFFFAOYSA-N

• 2,5-Diamino-1,3-benzenedisulfonic acid
IUPAC Name: 2,5-diaminobenzene-1,3-disulfonic acid | CAS Registry Number: 6409-48-9
Synonyms: 2,5-diaminobenzene-1,3-disulfonic acid, 2,5-DIAMINO-1,3-BENZENEDISULFONIC ACID, AGN-PC-00OMHL, CTK2F2940, MolPort-005-942-899, AKOS015891341, AG-G-40158, p-Phenylenediamine-2,6-disulfonic acid, AK112360, 1,3-Benzenedisulfonicacid, 2,5-diamino-, 1,3-Benzenedisulfonic acid, 2,5-diamino-, KB-165213, 2,5-bis(azanyl)benzene-1,3-disulfonic acid, FT-0636139, A834638, I01-9820, m-Benzenedisulfonicacid, 2,5-diamino- (7CI,8CI); 1,4-Diamino-2,6-benzenedisulfonic acid;1,4-Phenylenediamine-2,6-disulfonic acid; 2,5-Diamino-1,3-benzenedisulfonicacid; p-Phenylenediamine-2,6-disulfonic acid

Molecular Formula: C6H8N2O6S2Molecular Weight: 268.267520 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: QGNJPFLIBOTDKU-UHFFFAOYSA-N

• 2,4,6-Trichlorobenzonitrile
IUPAC Name: 2,4,6-trichlorobenzonitrile | CAS Registry Number: 6575-05-9
Synonyms: ZINC00167063, CID522179, ST5406943

Molecular Formula: C7H2Cl3NMolecular Weight: 206.456480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PGODHCIOIPODFE-UHFFFAOYSA-N

• (1R,2R)-(-)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol
IUPAC Name: (1R,2R)-2-amino-1-(4-nitrophenyl)propane-1,3-diol | CAS Registry Number: 716-61-0
Synonyms: Levoamine, Chloramphenicol base, A70704_ALDRICH, EINECS 211-938-7, LS-120138, TL8005023, D-(-)Threo-2-amino-1-(p-nitrophenyl)propane-1,3-diol, D-threo-(-)-2-Amino-1-(p-nitrophenyl)-1,3-propanediol, 1,3-Propanediol, 2-amino-1-(p-nitrophenyl)-, D-threo-(-)-, (1R,2R)-(−)-2-Amino-1-(4-nitrophenyl)-1,3-propanediol, D-(−)-threo-2-Amino-1-(p-nitrophenyl)-1,3-propanediol

Molecular Formula: C9H12N2O4Molecular Weight: 212.202580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: OCYJXSUPZMNXEN-RKDXNWHRSA-N

• 1,2-dichloro-4,5-dinitro-benzene
IUPAC Name: 1,2-dichloro-4,5-dinitrobenzene | CAS Registry Number: 6306-39-4
Synonyms: Parazol, 1,2-Dichloro-4,5-dinitrobenzene, 1,2diCl4,5diNO2Ph, 4,5-Dichloro-1,2-dinitrobenzene, WLN: WNR CG DG FNW, Benzene, 1,2-dichloro-4,5-dinitro-, 300365_ALDRICH, NSC 22945, AIDS006011, AIDS-006011, CID80565, NSC22945, BRN 2460868, AI3-19504, LS-29796, 4-05-00-00747 (Beilstein Handbook Reference)

Molecular Formula: C6H2Cl2N2O4Molecular Weight: 236.997080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IGSAVPVCQHAPSM-UHFFFAOYSA-N

• 3-Methoxysalicylic acid
IUPAC Name: 2-hydroxy-3-methoxybenzoic acid | CAS Registry Number: 877-22-5
Synonyms: o-Vanillic acid, Acide orthovanillique, 3-Hydroxy-m-anisic acid, 2-Hydroxy-3-methoxybenzoic acid, m-Anisic acid, 2-hydroxy-, WLN: QVR BQ CO1, Benzoic acid, 2-hydroxy-3-methoxy-, 196495_ALDRICH, 55546_FLUKA, EINECS 212-888-9, AIDS018088, NSC 134533, NSC 408167, AIDS-018088, BRN 2209642, NSC134533, NSC408167, LS-20097, ST5406420, Benzoic acid, 2-hydroxy-3-methoxy- (9CI)

Molecular Formula: C8H8O4Molecular Weight: 168.146720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: AUZQQIPZESHNMG-UHFFFAOYSA-N

• 2-ethyl-3,5-dimethylpyrazine
IUPAC Name: 2-ethyl-3,5-dimethylpyrazine | CAS Registry Number: 55031-15-7
Synonyms: 2-ETHYL-3,5-DIMETHYLPYRAZINE, 3,5-Dimethyl-2-ethylpyrazine, 13925-07-0, Pyrazine, 2-ethyl-3,5-dimethyl-, FEMA 3150, 2,6-Dimethyl-3-ethylpyrazine, 3-Ethyl-2,6-dimethylpyrazine, Pyrazine, 2,6-dimethyl-3-ethyl-, Pyrazine, 3,5-dimethyl-2-ethyl-, UNII-R182EY5L8C, FEMA No. 3149, 2-Ethyl-3,5-dimethyl pyrazine, EINECS 237-694-1, BRN 0636984, ACMC-1AJVY, AC1L1AX6, MLS000517293, SCHEMBL108874, CHEMBL328856, R182EY5L8C

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JZBCTZLGKSYRSF-UHFFFAOYSA-N

• 4,4'-Dinitrobibenzyl
IUPAC Name: 1-nitro-4-[2-(4-nitrophenyl)ethyl]benzene | CAS Registry Number: 736-30-1
Synonyms: 4,4'-Dinitrodibenzyl, p,p'-Dinitrobibenzyl, p,p'-Dinitrodibenzyl, Bibenzyl, 4,4'-dinitro-, 1,2-Bis(4-nitrophenyl)ethane, 1,2-Bis(p-nitrophenyl)ethane, Dinitro-4,4' dibenzyle, NSC 608, NCIOpen2_002512, Dinitro-4,4' dibenzyle [French], NSC608, 1,2-Ethanediylbis(4-nitrobenzene), EINECS 212-001-5, NSC 60022, 1,2-Ethanediylbis[4-nitrobenzene], CID69776, NSC60022, Bibenzyl, 4,4'-dinitro- (8CI), STK005038, ZINC01596369

Molecular Formula: C14H12N2O4Molecular Weight: 272.256080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BSNKHEKTRWNNAC-UHFFFAOYSA-N

• 1-Nitroanthraquinone
IUPAC Name: 1-nitroanthracene-9,10-dione | CAS Registry Number: 82-34-8
Synonyms: 1-Nitroanthrachinon, 1-NITROANTHRAQUINONE, Anthraquinone, 1-nitro-, alpha-Nitroanthraquinone, 1-Nitro-anthraquinone, 1-Nitroanthrachinon [Czech], .alpha.-Nitroanthraquinone, 9,10-Anthracenedione, 1-nitro-, 1-nitroanthra-9,10-quinone, EINECS 201-413-0, CID6704, NSC 12125, NSC12125, WLN: L C666 BV IVJ DNW, ZINC03850744, BAS 00337029, LS-20706

Molecular Formula: C14H7NO4Molecular Weight: 253.209680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: YCANAXVBJKNANM-UHFFFAOYSA-N

• 1-Amino Anthraquinone
IUPAC Name: 1-aminoanthracene-9,10-dione | CAS Registry Number: 82-45-1
Synonyms: Diazo Fast Red AL, Anthraquinone, 1-amino-, l-Aminoanthraquinone, 1-AMINOANTHRAQUINONE, 1-Aminoanthrachinon, alpha-Aminoanthraquinone, alpha-Anthraquinonylamine, 1-Amino-9,10-anthraquinone, 9,10-Anthracenedione, 1-amino-, 1-Aminoanthrachinon [Czech], .alpha.-Aminoanthraquinone, .alpha.-Anthraquinonylamine, NSC458, 1-Amino-9,10-anthracenedione, NSC 458, 9,10-Anthracenedione, amino-, 06770_FLUKA, A39009_SIAL, EINECS 201-423-5, CID6710

Molecular Formula: C14H9NO2Molecular Weight: 223.226760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KHUFHLFHOQVFGB-UHFFFAOYSA-N

• 1,1-Difluoroethane (Hfc152A)
IUPAC Name: 1,1-difluoroethane | CAS Registry Number: 75-37-6
Synonyms: Difluoroethane, Ethylidene fluoride, Ethylene fluoride, Propellant 152a, Halocarbon 152A, Refrigerant 152a, Ethane, 1,1-difluoro-, Genetron 152a, Algofrene type 67, Fluorocarbon 152a, Genetron 100, Ethylidene difluoride, Freon 152a, 1, 1-Difluoroethane, 1,1-DIFLUOROETHANE, Dymel 152A, Dymel 152, Hydrofluorocarbon 152a, HFC 152a, FC 152a

Molecular Formula: C2H4F2Molecular Weight: 66.049966 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NPNPZTNLOVBDOC-UHFFFAOYSA-N

• 1,3-Dibromopropane
IUPAC Name: 1,3-dibromopropane | CAS Registry Number: 109-64-8
Synonyms: 1,3-DIBROMOPROPANE, Trimethylene dibromide, Trimethylene bromide, Propane, 1,3-dibromo-, alpha,gamma-Dibromopropane, .alpha.,.gamma.-Dibromopropane, WLN: E3E, CCRIS 6711, EINECS 203-690-3, HSDB 7408, .omega.,.omega.'-Dibromopropane, NSC 62663, 125903_SIAL, NSC62663, AI3-28592, LS-119947, TL8000305, InChI=1/C3H6Br2/c4-2-1-3-5/h1-3H, 625084-38-0

Molecular Formula: C3H6Br2Molecular Weight: 201.887740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VEFLKXRACNJHOV-UHFFFAOYSA-N

• 1,3-Dichloro 5,5-Dimethylhydantoin
IUPAC Name: 1,3-dichloro-5,5-dimethylimidazolidine-2,4-dione | CAS Registry Number: 118-52-5
Synonyms: Dantoin, Dactin, Daktin, Dichlorantin, Omchlor, Halane, Hydan, Sulfochloranthine, Hydan (antiseptic), Caswell No. 306, Hydantoin, dichlorodimethyl-, Dwuchlorantyny [Polish], Ambap2964, NCI-C03054, CCRIS 5900, HSDB 4373, 1,3-DICHLORO-5,5-DIMETHYLHYDANTOIN, 232807_ALDRICH, 1,3-Dichloro-5,5-dimethyl hydantoin, Hydantoin, 1,3-dichloro-5,5-dimethyl-

Molecular Formula: C5H6Cl2N2O2Molecular Weight: 197.019340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KEQGZUUPPQEDPF-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

• 2,3 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-Dichloro Benzoic Acid
IUPAC Name: 2,3-dichlorobenzoic acid | CAS Registry Number: 50-45-3
Synonyms: 2,3-DICHLOROBENZOIC ACID, Benzoic acid, 2,3-dichloro-, 225339_ALDRICH, 34329_RIEDEL, EINECS 200-039-5, BRN 1946217, SBB003641, AI3-33364, FR-2156, LS-1305, NCGC00091187-01, TL8003347, 4-09-00-00998 (Beilstein Handbook Reference), InChI=1/C7H4Cl2O2/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QAOJBHRZQQDFHA-UHFFFAOYSA-N

• 2,4-Diamino-6-hydroxypyrimidine
IUPAC Name: 2,6-diamino-1H-pyrimidin-4-one | CAS Registry Number: 56-06-4
Synonyms: 2,6-Diamino-4-pyrimidinol, 2,4-Diaminohypoxanthine, Tocris-0476, 2,6-Diamino-4-pyrimidinone, 2,6-Diamino-4-hydroxypyrimidine, 4(1H)-Pyrimidinone, 2,6-diamino-, Lopac-D1920-6, 2,6-diaminopyrimidin-4-ol, Lopac0_000419, C4H6N4O, D19206_ALDRICH, MLS002153230, NSC9302, 2,4-DAHP, 2,6-Diamino-1H-pyrimidin-4-one, DHAP-2,4, NSC 9302, 33050_FLUKA, EINECS 200-254-4, NSC 44914

Molecular Formula: C4H6N4OMolecular Weight: 126.116640 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: SWELIMKTDYHAOY-UHFFFAOYSA-N


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