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• 2-Naphthylamine-1-Sulphonic Aicd
IUPAC Name: 2-aminonaphthalene-1-sulfonic acid | CAS Registry Number: 81-16-3
Synonyms: Tobias acid, Kyselina tobiasova, 2-Naphthylamine-1-sulfonic acid, Kyselina tobiasova [Czech], 2-AMINO-1-NAPHTHALENESULFONIC ACID, NCIOpen2_002342, 1-Naphthalenesulfonic acid, 2-amino-, WLN: L66J BSWQ CZ, 2-Naphthylamino,1-sulfonic acid, HSDB 5239, 291137_ALDRICH, CCRIS 9048, 2-aminonaphthalene-1-sulfonic acid, 2-Amino-naphthalenesulfonic acid, NSC 5523, 2-Aminonaphthalene-1-sulphonic acid, EINECS 201-331-5, NSC5523, AIDS001790, Kyselina 2-naftylamin-1-sulfonova

Molecular Formula: C10H9NO3SMolecular Weight: 223.248360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GWIAAIUASRVOIA-UHFFFAOYSA-N

• 6-Methoxy-1-Tetralone
IUPAC Name: 6-methoxy-3,4-dihydro-2H-naphthalen-1-one | CAS Registry Number: 1078-19-9
Synonyms: 6-Methoxy-1-tetralone, 6-Methoxy-.alpha.-tetralone, 6-methoxytetralin-1-one, 6-Methoxy-alpha-tetralone, M25589_ALDRICH, 1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-, AIDS017978, AIDS-017978, NSC41700, EINECS 214-078-0, NSC 41700, SBB007549, ZINC03850328, 6-Methoxy-3,4-dihydro-1(2H)-naphthalenone, 3,4-Dihydro-6-methoxy-1(2H)-naphthalenone, 6-methoxy-3,4-dihydro-2H-naphthalen-1-one, 6-Methoxy-3,4-dihydro-2H-naphthalin-1-on, 6-methoxy-3,4-dihydronaphthalen-1(2H)-one, 6-Methoxy-1,2,3,4-tetrahydro-1-naphthalenone, 6-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one

Molecular Formula: C11H12O2Molecular Weight: 176.211780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MNALUTYMBUBKNX-UHFFFAOYSA-N

• 1,3,5-Tribromobenzene
IUPAC Name: 1,3,5-tribromobenzene | CAS Registry Number: 626-39-1
Synonyms: 1,3,5-TRIBROMOBENZENE, Benzene, 1,3,5-tribromo-, NCIOpen2_008123, 140066_ALDRICH, NSC62439, 90715_FLUKA, EINECS 210-947-3, NSC 62439, CID12279, AI3-15483, LS-32209, TL806114, ST5406609, InChI=1/C6H3Br3/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3Br3Molecular Weight: 314.800020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YWDUZLFWHVQCHY-UHFFFAOYSA-N

• 1,5-Dichloroanthraquinone
IUPAC Name: 1,5-dichloroanthracene-9,10-dione | CAS Registry Number: 82-46-2
Synonyms: 1,5-Dichloranthrachinon, 1,5-Dichloroantraquinone, Maybridge1_002222, CBMicro_015239, 9,10-Anthracenedione, 1,5-dichloro-, ANTHRAQUINONE, 1,5-DICHLORO-, 1,5-Dichloro-9,10-anthraquinone, D56209_ALDRICH, 1,5-Dichloranthrachinon [Czech], EINECS 201-424-0, NSC 13969, AIDS017899, 1,5-Dichloroanthra-9,10-quinone, AIDS-017899, NSC13969, SBB001110, ZINC03860347, WLN: L C666 BV IVJ DG KG, AI3-38301, LS-20661

Molecular Formula: C14H6Cl2O2Molecular Weight: 277.102240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MQIUMARJCOGCIM-UHFFFAOYSA-N

• 4-Fluorobenzaldehyde
IUPAC Name: 4-fluorobenzaldehyde | CAS Registry Number: 459-57-4
Synonyms: p-Fluorobenzaldehyde, Benzaldehyde, 4-fluoro-, Benzaldehyde, p-fluoro-, 128376_ALDRICH, 46570_FLUKA, Benzaldehyde, p-fluoro- (8CI), NSC68095, EINECS 207-293-6, NSC 68095, ZINC00157154, TL806342, ST5213354, InChI=1/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5

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

InChIKey: UOQXIWFBQSVDPP-UHFFFAOYSA-N

• 2-Chlorophenothiazine
IUPAC Name: 2-chloro-10H-phenothiazine | CAS Registry Number: 92-39-7
Synonyms: 2-Chloro-10H-phenothiazine, 10H-Phenothiazine, 2-chloro-, 2-Chlorothiodiphenylamine, 2-CHLOROPHENOTHIZINE, PHENOTHIAZINE, 2-CHLORO-, Oprea1_205445, C63006_ALDRICH, NSC17469, 26495_FLUKA, EINECS 202-152-5, NSC 17469, AIDS031695, NSC 170953, WLN: T C666 BM ISJ EG, AIDS-031695, NSC67188, NSC170953, SBB003255, ZINC00035809, LS-105338

Molecular Formula: C12H8ClNSMolecular Weight: 233.716620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: KFZGLJSYQXZIGP-UHFFFAOYSA-N

• 1,8-Dichloroanthraquinone
IUPAC Name: 1,8-dichloroanthracene-9,10-dione | CAS Registry Number: 82-43-9
Synonyms: 1,8-Dichloranthrachinon, ANTHRAQUINONE, 1,8-DICHLORO-, 9,10-Anthracenedione, 1,8-dichloro-, 1,8-Dichloro-9,10-anthraquinone, D56403_ALDRICH, 1,8-Dichloranthrachinon [Czech], NSC7209, NSC 7209, EINECS 201-420-9, CID6708, BRN 1979205, ZINC03875552, WLN: L C666 BV IVJ DG NG, AI3-38302, LS-20662, 4-07-00-02560 (Beilstein Handbook Reference), T0502-7550

Molecular Formula: C14H6Cl2O2Molecular Weight: 277.102240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: VBQNYYXVDQUKIU-UHFFFAOYSA-N

• 5-Nitroindazole
IUPAC Name: 5-nitro-1H-indazole | CAS Registry Number: 5401-94-5
Synonyms: 5-Nitro-1H-indazole, 1H-INDAZOLE, 5-NITRO-, CCRIS 4134, MLS000728712, 216755_ALDRICH, NSC 5032, 73409_FLUKA, EINECS 226-451-5, ZERO/005563, NSC5032, BRN 0007936, ZINC00156104, FS000340, LS-81534, SMR000306991, ST5406182, 5-23-06-00180 (Beilstein Handbook Reference), AQ-776/40649175, 5NI, InChI=1/C7H5N3O2/c11-10(12)6-1-2-7-5(3-6)4-8-9-7/h1-4H,(H,8,9

Molecular Formula: C7H5N3O2Molecular Weight: 163.133500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WSGURAYTCUVDQL-UHFFFAOYSA-N

• 2,4-Dinitrochlorobenzene
IUPAC Name: 1-chloro-2,4-dinitrobenzene | CAS Registry Number: 97-00-7
Synonyms: Dinitrochlorobenzene, 1-chloro-2,4-dinitrobenzene, CDNB, DNCB, Dinitrochlorobenzol, Chlorodinitrobenzene, Caswell No. 389C, Benzene, 1-chloro-2,4-dinitro-, 2,4-Dinitrophenyl chloride, Dinitrochlorobenzene (VAN), 1,3-Dinitro-4-chlorobenzene, 2,4-Dinitro-1-chlorobenzene, 4-Chloro-1,3-dinitrobenzene, CID6, 1-Chlor-2,4-dinitrobenzol, WLN: WNR BG ENW, 1-Chlor-2,4-dinitrobenzene, 6-Chloro-1,3-dinitrobenzene, C6H3ClN2O4, CCRIS 1799

Molecular Formula: C6H3ClN2O4Molecular Weight: 202.552020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VYZAHLCBVHPDDF-UHFFFAOYSA-N

• 1,4-Dihydroxy Anthraquinone
IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione | CAS Registry Number: 81-64-1
Synonyms: Quinizarin, Chinizarin, Quinizarine, Smoke Orange R, 1,4-Dihydroxyanthraquinone, Macrolex Orange GG, Solvent Orange 86, 1,4-Doa [Russian], Anthraquinone, 1,4-dihydroxy-, 1,4-Dihydroxyanthrachinon, 1,4-Dioxyanthraquinone, 1,4-Dihydroxy-9,10-anthraquinone, Q906_ALDRICH, 1,4-Doa, CCRIS 3524, 9,10-Anthracenedione, 1,4-dihydroxy-, HSDB 5242, 1,4-Dioxyanthraquinone [Russian], MEGxp0_001867, 1,4-Dihydroxyanthrachinon [Czech]

Molecular Formula: C14H8O4Molecular Weight: 240.210920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GUEIZVNYDFNHJU-UHFFFAOYSA-N

• 1-Phenyl-3-Pyrazolidone (Phenidone A)
IUPAC Name: 1-phenylpyrazolidin-3-one | CAS Registry Number: 92-43-3
Synonyms: Fenidon, Phenidone, 1-Phenyl-3-pyrazolidone, 3-Pyrazolidinone, 1-phenyl-, 1-Phenyl-3-oxopyrazolidine, 1-Phenylpyrazolid-3-one, WLN: T5NMVTJ AR, 1-PHENYL-3-PYRAZOLIDINONE, ChemDiv3_006595, 2-Pyrazolin-3-ol, 1-phenyl-, CCRIS 3624, TimTec1_001225, 1-Phenyl-pyrazolidin-3-one, Oprea1_428400, P3441_SIGMA, 127914_ALDRICH, ARONIS011043, C9H10N2O, 1-P-3-P, 79070_FLUKA

Molecular Formula: C9H10N2OMolecular Weight: 162.188500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CMCWWLVWPDLCRM-UHFFFAOYSA-N

• 1-Aminoindan
IUPAC Name: 2,3-dihydro-1H-inden-1-amine | CAS Registry Number: 34698-41-4
Synonyms: 1-Aminoindane, 1-Indanamine, Indan-1-ylamine, NCIOpen2_000245, A59506_ALDRICH, NSC62540, EINECS 252-158-7, SBB004212, 1H-Inden-1-amine, 2,3-dihydro-, (+-)-, 1H-Inden-1-amine, 2,3-dihydro-, (.+/-.)-, 61949-83-5, InChI=1/C9H11N/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9H,5-6,10H

Molecular Formula: C9H11NMolecular Weight: 133.190340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XJEVHMGJSYVQBQ-UHFFFAOYSA-N

• 2-Chloro-5-Nitrobenzoic Acid
IUPAC Name: 2-chloro-5-nitrobenzoic acid | CAS Registry Number: 2516-96-3
Synonyms: 2-CHLORO-5-NITROBENZOIC ACID, Benzoic acid, 2-chloro-5-nitro-, 6-Chloro-3-nitrobenzoic acid, 125113_ALDRICH, NSC8441, AIDS019398, BB_SC-2802, AIDS-019398, NSC 8441, EINECS 219-739-7, 2-CHLORO,5-NITRO-BENZOIC ACID, AI3-16578, TL8002047, InChI=1/C7H4ClNO4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4ClNO4Molecular Weight: 201.563960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QUEKGYQTRJVEQC-UHFFFAOYSA-N

• 4 Cap
IUPAC Name: 2-amino-4-chlorophenol | CAS Registry Number: 95-85-2
Synonyms: Fouramine PY, 2-Amino-4-chlorophenol, p-Chloro-o-aminophenol, 4-Chloro-2-aminophenol, 2-Hydroxy-5-chloroaniline, 5-CHLORO-2-HYDROXYANILINE, C.I. Oxidation Base 18, Phenol, 2-amino-4-chloro-, CCRIS 4579, C44400_ALDRICH, EINECS 202-458-9, CID7265, UN2673, AIDS019916, NSC 247814, AIDS-019916, BRN 0774859, NSC247814, SBB007588, ZINC00404323

Molecular Formula: C6H6ClNOMolecular Weight: 143.570940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SWFNPENEBHAHEB-UHFFFAOYSA-N

• 2-(1-Phenylethyl) Hydroquinone
• 2,4-Diamino-6-Chloro Pyrimidine
IUPAC Name: 6-chloropyrimidine-2,4-diamine | CAS Registry Number: 156-83-2
Synonyms: 4-Chloro-2,6-diaminopyrimidine, 6-Chloro-2,4-diaminopyrimidine, C33204_ALDRICH, 2,4-Diamino-6-chloropyrimidine, 2,6-Diamino-4-chloropyrimidine, 4-chloro-2,6-diamino pyrimidine, NSC8818, AIDS022726, 2,4-Pyrimidinediamine, 6-chloro-, AIDS-022726, EINECS 205-863-9, 2-amino-6-chloro-4-pyrimidinylamine, SBB004123, ZINC00967399, AI3-51949, C-3550, AE-861/30098081

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

InChIKey: QJIUMVUZDYPQRT-UHFFFAOYSA-N

• 2,4-Dinitrophenylhydrazine
IUPAC Name: (2,4-dinitrophenyl)hydrazine | CAS Registry Number: 119-26-6
Synonyms: 2,4-Dnph, dinitrophenylhydrazine, Hydrazine, (2,4-dinitrophenyl)-, (2,4-Dinitrophenyl)hydrazine, 2,4-Dinitrofenylhydrazin, WLN: ZMR BNW DNW, 1-Hydrazino-2,4-dinitrobenzene, 2,4-dinitrophebylhydrazine, CCRIS 3140, D199303_ALDRICH, 2,4-Dinitrofenylhydrazin [Czech], 1-hydrazine-2,4-dinitrobenzene, NSC 5709, 1-(2,4-Dinitrophenyl)hydrazine, 18189_FLUKA, 42210_FLUKA, EINECS 204-309-3, NSC5709, BRN 0615586, ZINC03860431

Molecular Formula: C6H6N4O4Molecular Weight: 198.136240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HORQAOAYAYGIBM-UHFFFAOYSA-N

• 4-Nitrotoluene
IUPAC Name: 1-methyl-4-nitrobenzene | CAS Registry Number: 99-99-0
Synonyms: p-Nitrotoluene, 1-Methyl-4-nitrobenzene, 4-Nitrotoluol, 4-NITROTOLUENE, para-Nitrotoluol, Toluene, p-nitro-, p-Methylnitrobenzene, 4-Methylnitrobenzene, Nitrotoluene, p-, Benzene, 1-methyl-4-nitro-, p-nitrophenylmethane, Nitrotoluene, p-isomer, Nitrotoluenos [Spanish], 4-nitrotoluene hydride, Nitrotoluene, all isomers, WLN: WNR D1, CCRIS 2313, 4-nitrotoluene, ion (1-), N27322_ALDRICH, HSDB 1158

Molecular Formula: C7H7NO2Molecular Weight: 137.135980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZPTVNYMJQHSSEA-UHFFFAOYSA-N

• 3-Methylbutanol
IUPAC Name: 3-methylbutan-1-ol | CAS Registry Number: 123-51-3
Synonyms: Isoamyl alcohol, Isopentyl alcohol, Isopentanol, Isoamylol, Isobutylcarbinol, 3-Methylbutan-1-ol, Isobutyl carbinol, Fusel Oil, Iso-amylalkohol, Fuseloel, Iso-amyl alcohol, 1-Butanol, 3-methyl-, 2-Methyl-4-butanol, Isopentylalkohol, Amylowy alkohol, Isoamyl alkohol, Alcool amilico, Alcool isoamylique, ISOAMYLALCOHOL, Huile de fusel

Molecular Formula: C5H12OMolecular Weight: 88.148180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: PHTQWCKDNZKARW-UHFFFAOYSA-N

• 2,6-Dinitrotoluene
IUPAC Name: 2-methyl-1,3-dinitrobenzene | CAS Registry Number: 606-20-2
Synonyms: 2,6-DINITROTOLUENE, Toluene, 2,6-dinitro-, 2,6-Dinitromethylbenzene, 2-Methyl-1,3-dinitrobenzene, 2,6-DNT, Ambap5888, RCRA waste no. U106, RCRA waste number U106, 1-Methyl-2,6-dinitrobenzene, Benzene, 2-methyl-1,3-dinitro-, CCRIS 1006, CHEBI:957, HSDB 2931, D200603_ALDRICH, 1,3-Dinitro 2-methyl benzene, 45970_RIEDEL, SGCUT00101, EINECS 210-106-0, 2,4-/2,6-Dinitrotoluene mixture, CPD-9133

Molecular Formula: C7H6N2O4Molecular Weight: 182.133540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XTRDKALNCIHHNI-UHFFFAOYSA-N

• 4-Chlorobenzonitrile
IUPAC Name: 4-chlorobenzonitrile | CAS Registry Number: 623-03-0
Synonyms: p-Chlorobenzonitrile, p-Cyanochlorobenzene, Benzonitrile, p-chloro-, Benzonitrile, 4-chloro-, 4-CHLOROBENZONITRILE, p-CHLORBENZONITRILE, WLN: NCR DG, Nitril kyseliny p-chlorbenzoove, 115622_ALDRICH, NSC 6111, 23650_FLUKA, EINECS 210-765-4, NSC6111, AIDS018397, AIDS-018397, Nitril kyseliny p-chlorbenzoove [Czech], ZINC00157255, AI3-00492, LS-38654, TL8004098

Molecular Formula: C7H4ClNMolecular Weight: 137.566360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GJNGXPDXRVXSEH-UHFFFAOYSA-N

• 3,9-Dibromo Benzanthrone
IUPAC Name: 3,9-dibromobenzo[a]phenalen-7-one | CAS Registry Number: 81-98-1
Synonyms: 3,9-Dibrombenzanthrone, 3,9-Dibromobenzanthrone, 2,7-Dibromomesobenzanthrone, Benzanthrone, 3,9-dibromo-, 6-Bz-1-dibrombenzanthron, 6-Bz-1-Dibrombenzanthron [Czech], STOCK3S-48269, EINECS 201-391-2, NSC 84191, NSC84191, BRN 2055712, ZINC04578281, 3,9-Dibromo-7H-benz(de)anthracen-7-one, 3,9-Dibromo-benzo[de]anthracen-7-one, 7H-Benz(de)anthracen-7-one, 3,9-dibromo-, BAS 00112015, LS-27948, 3,9-Dibromo-7H-benz[de]anthracen-7-one, WLN: L C6666 1A Q IVJ FE OE, 7H-Benz[de]anthracen-7-one, 3,9-dibromo-

Molecular Formula: C17H8Br2OMolecular Weight: 388.052820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: XBZKJGBIPSQKAU-UHFFFAOYSA-N

• 2,3,4,4'-Tetrahydroxy Benzophenone
IUPAC Name: (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone | CAS Registry Number: 31127-54-5
Synonyms: 2,3,4,4'-Tetrahydroxybenzophenone, 2,3,4,4'-Tetrahydroxy benzophenone, (4-hydroxyphenyl)(2,3,4-trihydroxyphenyl)methanone, 311127-54-5, ZINC00507420, PubChem3404, AC1LJAAF, ACMC-1AJ2Q, AGN-PC-0D6W7V, DSSTox_CID_27932, DSSTox_RID_82685, DSSTox_GSID_47956, Oprea1_408626, KSC566I1H, Jsp005828, STOCK2S-11493, CTK4G6413, MolPort-002-560-214, GenBank AZ674294 (9CI), ACT07575

Molecular Formula: C13H10O5Molecular Weight: 246.215500 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 5

InChIKey: ZRDYULMDEGRWRC-UHFFFAOYSA-N

• 1-Hydroxybenzotriazole
IUPAC Name: 1-hydroxybenzotriazole | CAS Registry Number: 2592-95-2
Synonyms: Benzazimidol, Benzazimidol hydrate, 1H-Benzotriazole, 1-hydroxy-, N-Hydroxybenzotriazole hydrate, 1-Hydroxybenzotriazole hydrate, CCRIS 2605, MLS001006716, 1-Hydroxy-1H-benzotriazole hydrate, EINECS 219-989-7, 1-HYDROXY-1-H-BENZOTRIAZOLE, 1H-Benzotriazole, 1-hydroxy-, hydrate, BRN 0004515, ZINC00058261, LS-41548, SMR000349651, TL8002087, 4-26-00-00095 (Beilstein Handbook Reference), T0515-4929, 40150-21-8, 63307-62-0

Molecular Formula: C6H5N3OMolecular Weight: 135.123400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ASOKPJOREAFHNY-UHFFFAOYSA-N

• 1,3,(6 or 7)-Naphthalene Trisulfonic Acid
IUPAC Name: trisodium;naphthalene-2,3,6-trisulfonate;hydrate | CAS Registry Number: 123409-01-8
Synonyms: 1,3,(6,7)-Naphthalenetrisulfonic acid trisodium salt hydrate, zlchem 597, ZLD0044, ACT05822, ST51056502, trisodium naphthalene-2,3,6-trisulfonate hydrate, A805068, S14-0658

Molecular Formula: C10H7Na3O10S3Molecular Weight: 452.320888 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 10

InChIKey: IQIJZMTUEVJELZ-UHFFFAOYSA-K

• 2,4-Difluoroaniline
IUPAC Name: 2,4-difluoroaniline | CAS Registry Number: 367-25-9
Synonyms: 2,4-DIFLUOROANILINE, 2,4-Difluroaniline, Benzenamine, 2,4-difluoro-, Aniline, 2,4-difluoro-, 2,4-Difluorobenzenamine, CCRIS 4621, D101400_ALDRICH, 36870_FLUKA, EINECS 206-687-5, NSC 10297, LS-97, NSC10297, BRN 2802556, ZINC00157573, AI3-52650, SDCCGMLS-0066219.P001, NCGC00091684-01, SB 00555, TL8002710, 4-12-00-01112 (Beilstein Handbook Reference)

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CEPCPXLLFXPZGW-UHFFFAOYSA-N

• 2,5-Dichloroaniline
IUPAC Name: 2,5-dichloroaniline | CAS Registry Number: 95-82-9
Synonyms: 2,5-DICHLOROANILINE, Scarlet 2g base, Azobase DCA, Scarlet Base GG, Fast Scarlet 2G, Scarlet Base NGG, Diazol Scarlet 2Zh, Fast Red SGG Base, Hindamine Scarlet GG, Stabamine Scarlet GG, Scarlet Base Ciba I, Scarlet Salt Ciba I, Scarlet salt ngg, 2,5-Dichloranilin, Fast scarlet 2g base, Scarlet 2g salt, Aniline, 2,5-dichloro-, Fast Scarlet DS Base, Fast Scarlet GG Base, Lake Scarlet GG Base

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

InChIKey: AVYGCQXNNJPXSS-UHFFFAOYSA-N

• 2,4-Diaminotoluene
IUPAC Name: 4-methylbenzene-1,3-diamine | CAS Registry Number: 95-80-7
Synonyms: Toluenediamine, Developer mtd, m-Toluenediamine, Fouramine, Fourrine M, m-Tolylenediamine, 2,4-Toluenediamine, Benzofur MT, Developer DBJ, Eucanine GB, Pelagol J, Tertral G, Pelagol Grey J, Developer MT-CF, Zogen developer H, Brown for Fur T, 2,4-Toluene diamine, Developer B, Developer T, Fouramine J

Molecular Formula: C7H10N2Molecular Weight: 122.167700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VOZKAJLKRJDJLL-UHFFFAOYSA-N

• 2-Fluoro-4-hydroxybenzonitrile
IUPAC Name: 2-fluoro-4-hydroxybenzonitrile | CAS Registry Number: 82380-18-5
Synonyms: 417440_ALDRICH, ZINC00161696, KM 10855, InChI=1/C7H4FNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10

Molecular Formula: C7H4FNOMolecular Weight: 137.111163 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: REIVHYDACHXPNH-UHFFFAOYSA-N

• 4-Chloro-3-Nitrobenzoic Acid
IUPAC Name: 4-chloro-3-nitrobenzoic acid | CAS Registry Number: 96-99-1
Synonyms: 3-Nitro-4-chlorobenzoic acid, Benzoic acid, 4-chloro-3-nitro-, WLN: WNR BG EVQ, 4-CHLORO-3-NITROBENZOIC ACID, CCRIS 3126, C60007_ALDRICH, NSC 8440, 25450_FLUKA, EINECS 202-550-9, NSC8440, Kyselina 4-chloro-3-nitrobenzoova, BRN 0783626, SBB000404, 4-CHLORO-3-NITROBENZOIC ACIC, Kyselina 4-chloro-3-nitrobenzoova [Czech], LS-36572, TL8006017, 4-09-00-01226 (Beilstein Handbook Reference), InChI=1/C7H4ClNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11

Molecular Formula: C7H4ClNO4Molecular Weight: 201.563960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DFXQXFGFOLXAPO-UHFFFAOYSA-N

• 3,5-Dinitrobenzoic Acid
IUPAC Name: 3,5-dinitrobenzoic acid | CAS Registry Number: 99-34-3
Synonyms: Dinitrobenzoic acid, DNBA, 3,5-DINITROBENZOIC ACID, Benzoic acid, 3,5-dinitro-, 3-Carboxy-1,5-dinitrobenzene, CCRIS 3129, NCIOpen2_008996, 121258_ALDRICH, NSC 8732, EINECS 202-751-1, CID7433, NSC8732, SBB007840, AI3-01801, LS-37275, TL806408, ST5308043, BENZOIC ACID,3,5-DINITRO MFC7 H4 N2 O6, 57542-56-0, 64582-71-4

Molecular Formula: C7H4N2O6Molecular Weight: 212.116460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: VYWYYJYRVSBHJQ-UHFFFAOYSA-N

• 2-Naphthol
IUPAC Name: naphthalen-2-ol | CAS Registry Number: 135-19-3
Synonyms: beta-naphthol, 2-Naphthalenol, 2-NAPHTHOL, Betanaphthol, Isonaphthol, Developer sodium, Developer A, Developer BN, Naphthol B, Developer AMS, .beta.-Naphthol, beta-Napthol, 2-Hydroxynaphthalene, Azogen developer A, 2-Napththol, C.I. Developer 5, naphthalen-2-ol, beta-Hydroxynaphthalene, .beta.-Naftolo, .beta.-Naphtol

Molecular Formula: C10H8OMolecular Weight: 144.169920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JWAZRIHNYRIHIV-UHFFFAOYSA-N

• 4,4-Diamino Stilbene-2,2-Disulphonic Acid
IUPAC Name: 5-amino-2-[(E)-2-(4-amino-2-sulfophenyl)ethenyl]benzenesulfonic acid | CAS Registry Number: 81-11-8
Synonyms: Amsonsaeure, Flavonic acid, Amsonic acid, Tinopal BHS, DASD, Diaminostilbenedisulfonic acid, CCRIS 4778, HSDB 4239, NSC 163, NCI-C60162, NSC163, EINECS 201-325-2, 2,2'-Disulfo-4,4'-stilbenediamine, AIDS158065, AIDS-158065, BRN 0629516, NSC659761 (SODIUM SALT), p,p'-Diaminostilbene-o,o'-disulfonic acid, 4,4'-Diaminostilbene-2,2'-disulphonic acid, 4-4'-Diamino-2,2'-stilbenedisulphonic acid

Molecular Formula: C14H14N2O6S2Molecular Weight: 370.400760 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 8

InChIKey: REJHVSOVQBJEBF-OWOJBTEDSA-N

• 2,4-Dinitroaniline
IUPAC Name: 2,4-dinitroaniline | CAS Registry Number: 97-02-9
Synonyms: 2,4-DINITROANILINE, Aniline, 2,4-dinitro-, 2,4-Dinitraniline, Benzenamine, 2,4-dinitro-, 2,4-Dinitroanilin, 2,4-Dinitroanilina, 2,4-Dinitrobenzenamine, 2,4-Dinitrophenylamine, 1-Amino-2,4-dinitrobenzene, WLN: WNR BZ ENW, 2,4-Dinitroanilin [German], 2,4-Dinitroanilina [Italian], CCRIS 2872, ghl.PD_Mitscher_leg0.930, HSDB 1142, D193011_ALDRICH, 45963_RIEDEL, NCI-C60753, NSC 8731, EINECS 202-553-5

Molecular Formula: C6H5N3O4Molecular Weight: 183.121600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LXQOQPGNCGEELI-UHFFFAOYSA-N

• 3-Bromoanisole
IUPAC Name: 1-bromo-3-methoxybenzene | CAS Registry Number: 2398-37-0
Synonyms: m-Bromoanisole, Anisole, m-bromo-, m-Bromomethoxybenzene, m-Methoxybromobenzene, 3-Methoxybromobenzene, 3-Methoxy-1-bromobenzene, Benzene, 1-bromo-3-methoxy-, m-Bromophenyl methyl ether, 1-BROMO-3-METHOXYBENZENE, Anisole, m-bromo- (8CI), B56498_ALDRICH, NSC82293, EINECS 219-264-5, NSC 82293, SBB007886, ZINC00164414, FR-0521, TL8001981, B-5680, B-5700

Molecular Formula: C7H7BrOMolecular Weight: 187.033880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PLDWAJLZAAHOGG-UHFFFAOYSA-N

• 2-Methoxyethyl Cyanoacetate
IUPAC Name: 2-methoxyethyl 2-cyanoacetate | CAS Registry Number: 10258-54-5
Synonyms: 2-Methoxyethyl cyanoacetate, 411477_ALDRICH, EINECS 233-597-3, BRN 1766090, ZINC02023721, ACETIC ACID, CYANO-, 2-METHOXYETHYL ESTER, LS-11504, 4-02-00-01891 (Beilstein Handbook Reference)

Molecular Formula: C6H9NO3Molecular Weight: 143.140560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SGLKIEOMYXTGBH-UHFFFAOYSA-N

• 5-Chlorosalicylic Acid
IUPAC Name: 5-chloro-2-hydroxybenzoic acid | CAS Registry Number: 321-14-2
Synonyms: Salicylic acid, 5-chloro-, 5-CHLOROSALICYLIC ACID, 5 CSA, Ambap7310, 5-Chloro-2-hydroxybenzoic acid, Benzoic acid, 5-chloro-2-hydroxy-, 2-Hydroxy-5-chlorobenzoic acid, CCRIS 4485, Oprea1_451559, C70908_ALDRICH, EINECS 206-283-9, NSC 30111, AIDS018045, AIDS-018045, NSC30111, BRN 2046665, AI3-22259, LS-144275, 4-10-00-00207 (Beilstein Handbook Reference), InChI=1/C7H5ClO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,(H,10,11

Molecular Formula: C7H5ClO3Molecular Weight: 172.565800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NKBASRXWGAGQDP-UHFFFAOYSA-N

• 4-Fluorophenol
IUPAC Name: 4-fluorophenol | CAS Registry Number: 371-41-5
Synonyms: 4-FLUOROPHENOL, Phenol, p-fluoro-, p-Fluorophenol, Phenol, 4-fluoro-, CCRIS 665, F13207_ALDRICH, EINECS 206-736-0, NSC 10295, NSC10295, BRN 1362752, ZINC00164463, TL806436, LS-104664, ST5214377, C16485, 4-06-00-00773 (Beilstein Handbook Reference), FPN

Molecular Formula: C6H5FOMolecular Weight: 112.101703 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RHMPLDJJXGPMEX-UHFFFAOYSA-N

• 4,4'-Diamino-Diphenylamin-2'-Sulphonic Acid
IUPAC Name: 5-amino-2-(4-aminoanilino)benzenesulfonic acid | CAS Registry Number: 119-70-0
Synonyms: 6-(p-Aminoanilino)metanilic acid, NSC5622, 4,4'-Diamino-2-sulfodiphenylamine, 4-(p-Aminoanilino)-3-sulfoaniline, NSC4706, CID67070, NSC 4706, EINECS 204-344-4, SBB001129, 4,4'-Diaminodiphenylamine-2'-sulfonic acid, BAS 00531703, 4,4'-Diaminodiphenylamine-2-sulfonic acid, 5-Amino-2-(p-aminoanilino)benzenesulfonic acid, Diphenylamine-2-sulfonic acid, 4,4'-diamino-, AI3-23227, 5-Amino-2-(p-aminoanilino)benzenesulphonic acid, Benzenesulfonic acid, 5-amino-2-(p-aminoanilino)-, SR-01000636328-1, 5-Amino-2-(4-amino-phenylamino)-benzenesulfonic acid, Benzenesulfonic acid, 5-amino-2-((4-aminophenyl)amino)-

Molecular Formula: C12H13N3O3SMolecular Weight: 279.314920 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: VKURVCNKVWKGLX-UHFFFAOYSA-N

• 4,4'-Difluorobenzhydrol
IUPAC Name: bis(4-fluorophenyl)methanol | CAS Registry Number: 365-24-2
Synonyms: Bis(4-fluorophenyl)methanol, Bis-(4-fluorophenyl)-methanol, Bis(4-fluorophenyl) carbinol, 222682_ALDRICH, 4,4'-Difluorobenzhydryl alcohol, EINECS 206-671-8, ZINC00056553, ST5308446, TL8002694, Benzenemethanol, 4-fluoro-alpha-(4-fluorophenyl)-

Molecular Formula: C13H10F2OMolecular Weight: 220.214706 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WCTZPQWLFWZYJE-UHFFFAOYSA-N

• 6-Bromo-1-Hexanol
IUPAC Name: 6-bromohexan-1-ol | CAS Registry Number: 4286-55-9
Synonyms: 6-Bromohexanol, 6-Bromo-1-hexanol, 1-Hexanol, 6-bromo-, Hexamethylene bromohydrin, 6-BROMOHEXAN-1-OL, 186481_ALDRICH, CID77970, ZINC02242705, DB04637, BHL

Molecular Formula: C6H13BrOMolecular Weight: 181.070820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: FCMCSZXRVWDVAW-UHFFFAOYSA-N

• 2,5 Dichlorophenol
IUPAC Name: 2,5-dichlorophenol | CAS Registry Number: 583-78-8
Synonyms: 2,5-dichlorophenol, Phenol, 2,5-dichloro-, 3,6-dichlorophenol, Ambap5772, 2,5-DCP, 25-DICHLOROPHENOL, CCRIS 5903, D70007_ALDRICH, HSDB 4287, 35835_RIEDEL, 442320_SUPELCO, NSC 6296, 36140_FLUKA, CHEBI:27929, EINECS 209-520-4, NSC6296, BRN 1907692, c0545, ZINC00388512, LS-1409

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

InChIKey: RANCECPPZPIPNO-UHFFFAOYSA-N

• 4-Aminobenzamide
IUPAC Name: 4-aminobenzamide | CAS Registry Number: 2835-68-9
Synonyms: p-Aminobenzamide, Benzamide, 4-amino-, p-Carbamoylaniline, Benzamide, p-amino-, para-aminobenzamide, p-Aminobenzoic acid amide, CCRIS 6792, Oprea1_069284, Benzamide, p-amino- (8CI), 284572_ALDRICH, EINECS 220-612-3, NSC 36963, NSC 233920, NSC36963, NSC233920, ZINC00157169, LS-166276, ST5213825, TL8002252, C041338

Molecular Formula: C7H8N2OMolecular Weight: 136.151220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: QIKYZXDTTPVVAC-UHFFFAOYSA-N

• 2,6-Dichloro Para Nitro Aniline
IUPAC Name: 2,6-dichloro-4-nitroaniline | CAS Registry Number: 99-30-9
Synonyms: Dichloran, Dicloran, Ditranil, Allisan, Bortran, Resisan, Botran, Batran, DCNA, Dicloron, DCNA (fungicide), Arakonium chloride, Dicloran [BSI], Botran 45W, Caswell No. 311, 2,6-DICHLORO-4-NITROANILINE, Kiwi lustr 277, CDNA, Dichloran (amine fungicide), Benzenamine, 2,6-dichloro-4-nitro-

Molecular Formula: C6H4Cl2N2O2Molecular Weight: 207.014160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BIXZHMJUSMUDOQ-UHFFFAOYSA-N

• 4-Aminotoluene-3-Sulphonic Acid
IUPAC Name: 2-amino-5-methylbenzenesulfonic acid | CAS Registry Number: 88-44-8
Synonyms: Ptmsptmsa, PTMS, PTMSA, Red 4B acid, 4-Aminotoluene-3-sulfonic acid, 2-Amino-5-methylbenzenesulfonic acid, 6-Amino-m-toluenesulfonic acid, WLN: ZR B1 ESWQ, CCRIS 2772, m-Toluenesulfonic acid, 6-amino-, P-TOLUIDINE-M-SULFONIC ACID, 4-Aminotoluene-3-sulphonic acid, 6-Amino-m-toluensulfonic acid, 218766_ALDRICH, Benzenesulfonic acid, 2-amino-5-methyl-, NSC 7544, 4-Methylaniline-2-sulfonic acid, EINECS 201-831-3, Kyselina 4-toluidin-3-sulfonova, NSC7544

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

InChIKey: LTPSRQRIPCVMKQ-UHFFFAOYSA-N

• 2,9-Diacetylguanine
IUPAC Name: N-(9-acetyl-6-oxo-3H-purin-2-yl)acetamide | CAS Registry Number: 3056-33-5
Synonyms: N2,9-Diacetylguanine, Ambap758, 377899_ALDRICH, EINECS 221-287-0, SBB009975, TL8002355, N-(9-Acetyl-6,9-dihydro-6-oxo-1H-purin-2-yl)acetamide

Molecular Formula: C9H9N5O3Molecular Weight: 235.199460 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: GILZZWCROUGLIS-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


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