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1 [2]

• 3-Nitroaniline (CAS: 99-09-2)

• 2,3,4-Trifluoronitrobenzene

IUPAC Name: 1,2,3-trifluoro-4-nitrobenzene | CAS Registry Number: 771-69-7
Synonyms: Ambap5910, 1,2,3-Trifluoro-4-nitrobenzene, 338362_ALDRICH, 4-Nitro-1,2,3-trifluorobenzene, ZINC01845704, CID69871, EINECS 212-238-4, Benzene, 1,2,3-trifluoro-4-nitro-, T135

Molecular Formula:	C₆H₂F₃NO₂	Molecular Weight:	177.080790 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	5

InChIKey: ARCACZWMYGILNI-UHFFFAOYSA-N

• 2,5-Dichloronitrobenzene

IUPAC Name: 1,4-dichloro-2-nitrobenzene | CAS Registry Number: 89-61-2
Synonyms: Nitro-p-dichlorobenzene, 2,5-DICHLORONITROBENZENE, 2,5-Dichloronitrobenzol, 1,4-Dichloro-2-nitrobenzene, 2,5-Dichlornitrobenzen, 1-Nitro-2,5-dichlorobenzene, Benzene, 1,4-dichloro-2-nitro-, Benzene, 2,5-dichloronitro-, WLN: WNR CG EG, CCRIS 3096, 2,5-Dichlornitrobenzen [Czech], 225371_ALDRICH, 36572_RIEDEL, 36040_FLUKA, EINECS 201-923-3, NSC6294, NSC 406125, BRN 0778109, NSC406125, ZINC01693389

Molecular Formula:	C₆H₃Cl₂NO₂	Molecular Weight:	191.999520 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: RZKKOBGFCAHLCZ-UHFFFAOYSA-N

• 3,4,5-Trimethoxytoluene

IUPAC Name: 1,2,3-trimethoxy-5-methylbenzene | CAS Registry Number: 6443-69-2
Synonyms: Toluene, 3,4,5-trimethoxy-, 227714_ALDRICH, 1,2,3-Trimethoxy-5-methylbenzene, 92196_FLUKA, Benzene, 1,2,3-trimethoxy-5-methyl-, 5-Methylpyrogallol trimethyl ether, EINECS 229-239-0, ZINC00391984, ST5406464, TL8004566, InChI=1/C10H14O3/c1-7-5-8(11-2)10(13-4)9(6-7)12-3/h5-6H,1-4H

Molecular Formula:	C₁₀H₁₄O₃	Molecular Weight:	182.216360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: KCIZTNZGSBSSRM-UHFFFAOYSA-N

• 4-Diaminobenzene (4-Phenylenediamine)

IUPAC Name: benzene-1,4-diamine | CAS Registry Number: 106-50-3
Synonyms: p-Phenylenediamine, p-Aminoaniline, 4-Aminoaniline, p-Diaminobenzene, Orsin, p-Phenyldiamine, p-Benzenediamine, Fouramine D, Futramine D, Benzofur D, Developer PF, Fourrine D, Fur Yellow, Santoflex IC, Santoflex LC, 1,4-Phenylenediamine, Pelagol D, Tertral D, Durafur Black R, Pelagol DR

Molecular Formula:	C₆H₈N₂	Molecular Weight:	108.141120 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: CBCKQZAAMUWICA-UHFFFAOYSA-N

• 4 4 Dihydroxy Diphenyl Sulphone

IUPAC Name: 4-(4-hydroxyphenyl)sulfonylphenol | CAS Registry Number: 80-09-1
Synonyms: Bisphenol S, 4,4'-Sulfonyldiphenol, Diphone C, 2,4'-Sulfonyldiphenol, 4-Hydroxyphenyl sulfone, 4,4'-Sulfonylbisphenol, 4,4'-Bisphenol S, 4,4'-Sulphonyldiphenol, Bis(4-hydroxyphenyl) sulfone, p,p'-Sulfonyldiphenol, Phenol, 4,4'-sulfonylbis-, Ambap5851, Bis(p-hydroxyphenyl) sulfone, Bis(p-hydroxyphenyl)sulfone, Bis(4-hydroxyphenyl)sulfone, WLN: QR DSWR DQ, BPS 1, 4,4'-Dihydroxydiphenyl sulfone, ChemDiv3_000253, PHENOL, 4,4'-SULFONYLDI-

Molecular Formula:	C₁₂H₁₀O₄S	Molecular Weight:	250.270400 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: VPWNQTHUCYMVMZ-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:	C₇H₅FO	Molecular Weight:	124.112403 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: UOQXIWFBQSVDPP-UHFFFAOYSA-N

• 4-Phenylbutyric Acid

IUPAC Name: 4-phenylbutanoic acid | CAS Registry Number: 1821-12-1
Synonyms: Benzenebutanoic acid, 4-Phenylbutanoic acid, Benzenebutyric acid, 4-PHENYLBUTYRIC ACID, 1-Phenylbutyric acid, 4-phenylbutyrate, Phenylbutyric acid, Butyric acid, 4-phenyl-, gamma-Phenylbutyric acid, omega-Phenylbutanoic acid, Spectrum_001331, 2ay7, Sodium 4-phenylbutyrate, SpecPlus_000814, Spectrum2_001798, Spectrum3_000782, Spectrum4_000092, Spectrum5_001003, HDInhib_000004, .gamma.-Phenylbutyric acid

Molecular Formula:	C₁₀H₁₂O₂	Molecular Weight:	164.201080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: OBKXEAXTFZPCHS-UHFFFAOYSA-N

• 1,2,2,6,6-Pentamethyl-4-Piperidinol

IUPAC Name: 1,2,2,6,6-pentamethylpiperidin-4-ol | CAS Registry Number: 2403-89-6
Synonyms: 03225_FLUKA, ZERO/006223, NSC364075, CID75472, EINECS 219-292-8, NSC 364075, 1,2,2,6,6-Pentamethyl-4-piperidinol, 1,2,2,6,6-Pentamethylpiperidin-4-ol, 4-Piperidinol, 1,2,2,6,6-pentamethyl-, 1,2,2,6,6-Pentamethyl-4-hydroxypiperidine, 4-Hydroxy-1,2,2,6,6-pentamethylpiperidine

Molecular Formula:	C₁₀H₂₁NO	Molecular Weight:	171.279840 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NWHNXXMYEICZAT-UHFFFAOYSA-N

• 1-Chloroanthraquinone

IUPAC Name: 1-chloroanthracene-9,10-dione | CAS Registry Number: 82-44-0
Synonyms: Anthraquinone, 1-chloro-, Chloroanthraquinone, 1-CHLOROANTHRAQUINONE, alpha-Chloroanthraquinone, 1-Chloro-9,10-anthraquinone, 9,10-Anthracenedione, 1-chloro-, alpha-Monochloroanthraquinone, 1-Chloranthrachinon [Czech], .alpha.-Chloroanthraquinone, C23209_ALDRICH, Chloro-9,10-anthracenedione, HSDB 2565, .alpha.-Monochloroanthraquinone, 1-Chloroanthra-9,10-quinone, 9,10-Anthracenedione, chloro-, EINECS 201-421-4, NSC5138, NSC 30428, AIDS001366, WLN: L C666 BV IVJ DG

Molecular Formula:	C₁₄H₇ClO₂	Molecular Weight:	242.657180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: BOCJQSFSGAZAPQ-UHFFFAOYSA-N

• 4-Aminobenzoic Acid

IUPAC Name: 4-aminobenzoic acid | CAS Registry Number: 150-13-0
Synonyms: 4-aminobenzoic acid, p-aminobenzoic acid, Hachemina, Paraminol, Pabafilm, Pabamine, Paranate, Pabacyd, Amben, p-Carboxyaniline, Papacidum, Sunbrella, Romavit, RVPaba Lipstick, p-aminobenzoate, Potaba, Rvpaba, 4-Carboxyaniline, Vitamin BX, 4-aminobenzoate

Molecular Formula:	C₇H₇NO₂	Molecular Weight:	137.135980 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: ALYNCZNDIQEVRV-UHFFFAOYSA-N

• 4,4'-Sulfonyldiphenol (CAS: 8-9-1)

• 2-Methyl-3-Butyn-2-OL

IUPAC Name: 2-methylbut-3-yn-2-ol | CAS Registry Number: 115-19-5
Synonyms: 3-Methylbutynol, Carbavane, Ethynyldimethylcarbinol, 2-Methyl-2-butynol, Dimethylethynylcarbinol, Dimethylethynylmethanol, 3-Butyn-2-ol, 2-methyl-, Carbavane [Russian], Dimethylacetylenecarbinol, 1,1-Dimethylpropynol, Dimethylacetylenylcarbinol, 2-Methylbut-3-yn-2-ol, 3-Methyl-butyn-3-ol, 3-Methyl-1-butyn-3-ol, 1,1-Dimethyl-2-propynol, 2-METHYL-3-BUTYN-2-OL, 2-Methylbutyn-3-ol-2, 1,1-Dimethylpropargyl alcohol, Dimethyl ethynyl carbinol, 1-Butyn-3-ol, 3-methyl-

Molecular Formula:	C₅H₈O	Molecular Weight:	84.116420 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: CEBKHWWANWSNTI-UHFFFAOYSA-N

• 3-Methylanisole

IUPAC Name: 1-methoxy-3-methylbenzene | CAS Registry Number: 100-84-5
Synonyms: m-Methylanisole, 3-Methoxytoluene, Anisole, m-methyl-, Methyl m-tolyl ether, m-Cresol methyl ether, Methyl m-cresyl ether, 3-Methylmethoxybenzene, M-METHOXYTOLUENE, m-Cresyl methyl ether, 1-Methoxy-3-methylbenzene, Benzene, 1-methoxy-3-methyl-, 1-Methyl-3-methoxybenzene, Methyl 3-methylphenyl ether, Ambap1726, 149160_ALDRICH, NSC 6255, EINECS 202-893-4, NSC6255, ZINC01693360, AI3-19476

Molecular Formula:	C₈H₁₀O	Molecular Weight:	122.164400 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: OSIGJGFTADMDOB-UHFFFAOYSA-N

• 5-Methoxy-2-methylaniline

IUPAC Name: 5-methoxy-2-methylaniline | CAS Registry Number: 50868-72-9
Synonyms: 6-Methyl-m-anisidine, 5-Methoxy-o-toluidine, 2-Amino-4-methoxytoluene, Benzenamine, 5-methoxy-2-methyl-, 335436_ALDRICH, MolPort-001-791-940, NSC229308, CID99500, EINECS 256-816-4, ZINC00157567, LT03332119, InChI=1/C8H11NO/c1-6-3-4-7(10-2)5-8(6)9/h3-5H,9H2,1-2H

Molecular Formula:	C₈H₁₁NO	Molecular Weight:	137.179040 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: RPJXLEZOFUNGNZ-UHFFFAOYSA-N

• 1-Bromobutane

IUPAC Name: 1-bromobutane | CAS Registry Number: 109-65-9
Synonyms: Butyl bromide, Butane, 1-bromo-, n-Butylbromide, Bromobutane, N-BUTYL BROMIDE, 1-Butyl bromide, Butane, bromo-, sJPHAbIJuP@, 1-BROMO-BUTANE, CCRIS 831, HSDB 2195, 08953_FLUKA, 19681_FLUKA, B59497_SIAL, EINECS 203-691-9, UN1126, AI3-15308, LS-45622, TL8000306, 1-Bromobutane [UN1126] [Flammable liquid]

Molecular Formula:	C₄H₉Br	Molecular Weight:	137.018260 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: MPPPKRYCTPRNTB-UHFFFAOYSA-N

• 2,3,4-Trifluoroaniline

IUPAC Name: 2,3,4-trifluoroaniline | CAS Registry Number: 3862-73-5
Synonyms: 2,3,4-Trifluoranilin, Aniline, 2,3,4-trifluoro-, Benzenamine, 2,3,4-trifluoro-, 304352_ALDRICH, 2,3,4-Trifluoranilin [Danish], 2,3,4-Trifluoranilin [German], 2,3,4-Trifluoraniline [Dutch], 2,3,4-Trifluoroaniline [French], 2,3,4-Trifluoroanilina [Italian], 2,3,4-Trifluoroanilina [Spanish], JRD-0607, BRN 3245609, SBB012347, ZINC00164526, 2,3,4-Trifluoroanilina [Portuguese], LS-28441, EE4071709, TL8002814, 4-12-00-01114 (Beilstein Handbook Reference), 3S211006

Molecular Formula:	C₆H₄F₃N	Molecular Weight:	147.097870 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: WRDGNXCXTDDYBZ-UHFFFAOYSA-N

• 4-Aminoanisole

IUPAC Name: 4-methoxyaniline | CAS Registry Number: 104-94-9
Synonyms: p-Anisidine, 4-Methoxyaniline, p-Aminoanisole, p-Anisylamine, p-Methoxyaniline, 4-Anisidine, p-Dianisidine, p-Methoxyphenylamine, Benzenamine, 4-methoxy-, Anisole, p-amino-, 4-Methoxybenzenamine, 4-Methoxybenzeneamine, Aniline, p-methoxy-, Aniline, 4-methoxy-, 1-Amino-4-methoxybenzene, 4-Methoxy-1-aminobenzene, 4-METHYOXYANILINE, 4-METHOXY-ANILINE, CCRIS 917, WLN: ZR DO1

Molecular Formula:	C₇H₉NO	Molecular Weight:	123.152460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: BHAAPTBBJKJZER-UHFFFAOYSA-N

• 1,2-Dibromoethane

IUPAC Name: 1,2-dibromoethane | CAS Registry Number: 106-93-4
Synonyms: Ethylene bromide, sym-Dibromoethane, Aadibroom, Bromofume, Sanhyuum, Soilbrom, Soilfume, Celmide, Edabrom, Kopfume, Unifume, Nephis, Nefis, ETHYLENE DIBROMIDE, Glycol Dibromide, Iscobrome D, Fumo-gas, Dibromoethylene, Pestmaster, dibromoet hane

Molecular Formula:	C₂H₄Br₂	Molecular Weight:	187.861160 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: PAAZPARNPHGIKF-UHFFFAOYSA-N

• 2-Acetyl-6-Methoxy Naphthalene

IUPAC Name: 1-(6-methoxynaphthalen-2-yl)ethanone | CAS Registry Number: 3900-45-6
Synonyms: 2-Acetyl-6-methoxynaphthalene, NCIOpen2_002197, 6'-Methoxy-2'-acetonaphthone, 399019_ALDRICH, 1-(6-Methoxy-2-naphthyl)ethanone, EINECS 223-453-8, NSC105564, ZINC00164714, 1-(6-Methoxy-2-naphthyl)ethan-1-one, Ethanone, 1-(6-methoxy-2-naphthalenyl)-, ST5319415, TL8002824

Molecular Formula:	C₁₃H₁₂O₂	Molecular Weight:	200.233180 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: GGWCZBGAIGGTDA-UHFFFAOYSA-N

• 3-Amino Acetanilide

IUPAC Name: N-(3-aminophenyl)acetamide | CAS Registry Number: 102-28-3
Synonyms: 3'-Aminoacetanilide, M-Acetaminoaniline, M-AMINOACETANILIDE, 3-Acetylaminoaniline, 3-Aminoacetanilid, m-(Acetylamino)aniline, Acetanilide, 3'-amino-, 3-Amino-N-acetylaniline, N-Acetyl-m-phenylenediamine, N-(3-Aminophenyl)acetamide, 3-(Acetylamino)aniline, 3-Aminoacetanilid [Czech], Acetamide, N-(3-aminophenyl)-, N-Acetyl-m-fenylenediamin, 1-Amino-3-(acetylamino)benzene, WLN: ZR CMV1, CCRIS 4574, N-Acetyl-m-fenylendiamin [Czech], 485055_ALDRICH, ARONIS013944

Molecular Formula:	C₈H₁₀N₂O	Molecular Weight:	150.177800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: PEMGGJDINLGTON-UHFFFAOYSA-N

• 4-Fluorobenzoyl Chloride

IUPAC Name: 4-fluorobenzoyl chloride | CAS Registry Number: 403-43-0
Synonyms: 4-Fluorobenzoyl chloride, p-Fluorobenzoyl chloride, Benzoyl chloride, 4-fluoro-, Benzoyl chloride, p-fluoro-, p-Fluorobenzoic acid chloride, 119946_ALDRICH, 46760_FLUKA, NSC88305, EINECS 206-961-4, NSC 88305, ZINC01847456, F159, ST5214061, TL8002936

Molecular Formula:	C₇H₄ClFO	Molecular Weight:	158.557463 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: CZKLEJHVLCMVQR-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:	C₇H₄Cl₂O₂	Molecular Weight:	191.011460 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: QAOJBHRZQQDFHA-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:	C₁₄H₁₂O₃	Molecular Weight:	228.243280 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: DXGLGDHPHMLXJC-UHFFFAOYSA-N