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• 4-Chloro-3-Amino Benzotriflouride

IUPAC Name: 2-chloro-5-(trifluoromethyl)aniline | CAS Registry Number: 121-50-6
Synonyms: Orange Salt NRD, Fast Orange RD Oil, Fast Orange RD Salt, Fast Orange Salt RD, Daito Orange Salt RD, Diazo Fast Orange RD, Fast Orange Salt RDA, Fast Orange Salt RDN, 3-Amino-4-chlorobenzotrifluoride, Sanyo Fast Orange Salt RD, Azoene Fast Orange RD Salt, USAF MA-13, Hiltosal Fast Orange RD Salt, WLN: ZR BG EXFFF, 4-Chloro-3-aminobenzotrifluoride, 2-Chloro-5-(trifluoromethyl)aniline, CCRIS 2816, 07430_ALDRICH, 6-Chloro-3-(trifluoromethyl)aniline, Benzenamine, 2-chloro-5-(trifluoromethyl)-

Molecular Formula:	C₇H₅ClF₃N	Molecular Weight:	195.569510 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: VKTTYIXIDXWHKW-UHFFFAOYSA-N

• 4-Chlororesorcinol

IUPAC Name: 4-chlorobenzene-1,3-diol | CAS Registry Number: 95-88-5
Synonyms: p-Chlororesorcinol, 4-Chlororesorcin, Resorcinol, 4-chloro-, 6-Chlororesorcinol, 1,3-Benzenediol, 4-chloro-, 4-Chloro-1,3-benzenediol, 2,4-Dihydroxychlorobenzene, 4-Chloro-1,3-dihydroxybenzene, WLN: QR CQ DG, C70606_ALDRICH, 1,3-Dihydroxy-4-chlorobenzene, NSC 1569, EINECS 202-462-0, NSC1569, NSC6298, AIDS017781, AIDS-017781, BRN 2042864, ZINC00404336, C.I. 76510

Molecular Formula:	C₆H₅ClO₂	Molecular Weight:	144.555700 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: JQVAPEJNIZULEK-UHFFFAOYSA-N

• 1,3,5-Trichlorobenzene (TCB)

IUPAC Name: 1,3,5-trichlorobenzene | CAS Registry Number: 108-70-3
Synonyms: s-Trichlorobenzene, sym-Trichlorobenzene, 1,3,5-TRICHLOROBENZENE, Benzene, 1,3,5-trichloro-, 1,3,5-Trichlorbenzol, CCRIS 5946, HSDB 132, 1,3,5-TRICHLORO-BENZENE, T54607_ALDRICH, 36555_RIEDEL, 442235_SUPELCO, NSC 4389, CHEBI:49916, EINECS 203-608-6, NSC4389, LS-468, AI3-22031, DB03836, NCGC00091181-01, TL806428

Molecular Formula:	C₆H₃Cl₃	Molecular Weight:	181.447020 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: XKEFYDZQGKAQCN-UHFFFAOYSA-N

• 2-Chloroquinoxaline

IUPAC Name: 2-chloroquinoxaline | CAS Registry Number: 1448-87-9
Synonyms: 2-CHLOROQUINOXALINE, Quinoxaline, 2-chloro-, 136301_ALDRICH, NSC43553, CID238938

Molecular Formula:	C₈H₅ClN₂	Molecular Weight:	164.591700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: BYHVGQHIAFURIL-UHFFFAOYSA-N

• 4 - Bromobenzaldehyde

IUPAC Name: 4-bromobenzaldehyde | CAS Registry Number: 1122-91-4
Synonyms: 4-Bromobenzaldehyde, p-Bromobenzaldehyde, Benzaldehyde, 4-bromo-, Benzaldehyde, p-bromo-, nchembio.149-comp26, BENZALDEHYDE,4-BROMO, B57400_ALDRICH, EINECS 214-365-0, NSC 21638, NSC21638, SBB007609, ZINC00039555, LS-24929, AB-131/40654019, InChI=1/C7H5BrO/c8-7-3-1-6(5-9)2-4-7/h1-5

Molecular Formula:	C₇H₅BrO	Molecular Weight:	185.018000 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZRYZBQLXDKPBDU-UHFFFAOYSA-N

• 2,2'-Dithiosalicylic Acid

IUPAC Name: 2-(2-carboxyphenyl)disulfanylbenzoic acid | CAS Registry Number: 119-80-2
Synonyms: Dithiosalicylic acid, 2,2'-Dithiodibenzoic acid, Bis(2-carboxyphenyl) disulfide, 2-Carboxyphenyl disulfide, Bis(o-carboxylphenyl) disulfide, Disulfide benzamide analog, Benzoic acid, 2,2'-dithiobis-, Bis(o-carboxyphenyl) disulfide, 2,2'-Dithiodi(benzoic acid), 2,2'-Dithiosalicylic acid, NSC213, 2,2'-Dithiobis(benzoic acid), MLS001216615, NSC 213, NSC5346, 2,2'-Dithiobis[benzoic acid], 389285_ALDRICH, NSC 5346, 43761_FLUKA, BENZOIC ACID, 2,2'-DITHIODI-

Molecular Formula:	C₁₄H₁₀O₄S₂	Molecular Weight:	306.356800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: LBEMXJWGHIEXRA-UHFFFAOYSA-N

• 2-Aminophenol

IUPAC Name: 2-aminophenol | CAS Registry Number: 95-55-6
Synonyms: o-Hydroxyaniline, O-AMINOPHENOL, 2-Hydroxyaniline, Fouramine OP, Benzofur GG, Phenol, o-amino-, Pelagol Grey GG, 2-Aminobenzenol, Pelagol 3GA, Phenol, 2-amino-, Nako Yellow ga, Nako Yellow 3GA, Questiomycin B, BASF ursol 3GA, ortho-aminophenol, Zoba 3GA, 2-Hydroxyanaline, o-Hydroxyphenylamine, Paradone Olive Green B, 2-Amino-1-hydroxybenzene

Molecular Formula:	C₆H₇NO	Molecular Weight:	109.125880 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: CDAWCLOXVUBKRW-UHFFFAOYSA-N

• 1-Naphthoic Acid

IUPAC Name: naphthalene-1-carboxylic acid | CAS Registry Number: 86-55-5
Synonyms: 1-NAPHTHOIC ACID, 1-Carboxynaphthalene, alpha-Naphthoic acid, Carboxynaphthalene, 1-Naphthalenecarboxylic acid, NAPHTHOIC ACID, Naphthalenecarboxylic acid, .alpha.-Naphthoic acid, alpha-Naphthylcarboxylic acid, N1909_ALDRICH, naphthalene-1-carboxylic acid, Naphthalene-alpha-carboxylic acid, 70389_FLUKA, 70390_FLUKA, CHEBI:36466, EINECS 201-681-9, NSC 37569, AIDS034420, AIDS-034420, NSC37569

Molecular Formula:	C₁₁H₈O₂	Molecular Weight:	172.180020 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: LNETULKMXZVUST-UHFFFAOYSA-N

• 2-Methyl-5-Ethyl Pyridine

IUPAC Name: 5-ethyl-2-methylpyridine | CAS Registry Number: 104-90-5
Synonyms: Aldehydkollidin, Aldehydine, 5-Ethyl-2-methylpyridine, Aldehydecollidine, 5-Ethyl-2-picoline, 2-Picoline, 5-ethyl-, 2,5-Aldehydine, Pyridine, 5-ethyl-2-methyl-, 3-Ethyl-6-methylpyridine, 5-Ethyl-alpha-picoline, 6-Methyl-3-ethylpyridine, Methyl ethyl pyridine, Collidine, aldehydecollidine, MEP (VAN), 5-Ethyl-.alpha.-picoline, 2-METHYL-5-ETHYLPYRIDINE, FEMA No. 3546, HSDB 5137, W354600_ALDRICH, WLN: T6NJ B1 E2

Molecular Formula:	C₈H₁₁N	Molecular Weight:	121.179640 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: NTSLROIKFLNUIJ-UHFFFAOYSA-N

• 2 5-Dimethyl Hexane-2 5-Diol

IUPAC Name: 2,5-dimethylhexane-2,5-diol | CAS Registry Number: 110-03-2
Synonyms: Dimethylhexanediol, 2,5-Hexanediol, 2,5-dimethyl-, 2,5-Dimethylhexanediol, 2,5-Dimethylhexane-2,5-diol, MLS001055396, 2,5-DIMETHYL-2,5-HEXANEDIOL, 1,1,4,4-Tetramethyl-1,4-butanediol, 143618_ALDRICH, HSDB 5395, NSC5595, NSC 5595, EINECS 203-731-5, ZINC02504411, NCGC00090935-01, SMR000677933, 2,5-DIHYDROXY-2,5-DIMETHYLHEXANE, AI3-20685

Molecular Formula:	C₈H₁₈O₂	Molecular Weight:	146.227320 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZWNMRZQYWRLGMM-UHFFFAOYSA-N

• 2-Anthraquinonesulfonic Acid, Sodium Salt

IUPAC Name: sodium 9,10-dioxoanthracene-2-sulfonic acid | CAS Registry Number: 131-08-8
Synonyms: Silver salt, 2-Anthraquinonesulfonate sodium, Sodium 2-anthrachinonesulfonate, Sodium 2-anthraquinonesulfonate, Sodium 2-anthrachinonesulphonate, 2-Anthraquinone sodium sulfonate, 2-Sulfoanthraquinone sodium salt, Anthraquinone-2-sodium sulfonate, Sodium-2-anthrachinonesulphonate, Anthrachinon-1-sulfonan sodny, Sodium beta-anthraquinonesulfonate, Anthraquinone-2-sulfonate sodium salt, 9,10-Anthraquinone-2-sodium sulfonate, EINECS 205-009-5, Sodium 9,10-anthraquinone-2-sulfonate, 2-Anthraquinonesulfonic acid sodium salt, NSC4757, NSC 215188, Sodium .beta.-anthraquinonesulfonate, AI3-17983

Molecular Formula:	C₁₄H₈NaO₅S+	Molecular Weight:	311.265090 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: GGCZERPQGJTIQP-UHFFFAOYSA-N

• 2-Mercapto-1,3,4-Thiadiazole

IUPAC Name: 3H-1,3,4-thiadiazole-2-thione | CAS Registry Number: 18686-82-3
Synonyms: 5-Mercapto-1,3,4-thiadiazole, 1,3,4-Thiadiazole-2(3H)-thione, EINECS 242-504-5, NSC184817, ZINC05226028, NSC 184817, ST5214737, 50268-94-5

Molecular Formula:	C₂H₂N₂S₂	Molecular Weight:	118.180680 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: JLAMDELLBBZOOX-UHFFFAOYSA-N

• 4-Chloro-Meta-Cresol

IUPAC Name: 4-chloro-3-methylphenol | CAS Registry Number: 59-50-7
Synonyms: Chlorocresol, 4-Chloro-m-cresol, Candaseptic, Peritonan, Baktolan, Ottafact, Parmetol, Raschit, Baktol, Aptal, Parol, p-Chloro-m-cresol, p-Chlorocresol, Rasen-Anicon, Chlorcresolum, Chlorkresolum, Chlorocresolo, Chlorokresolum, 4-Chloro-3-methylphenol, Preventol CMK

Molecular Formula:	C₇H₇ClO	Molecular Weight:	142.582880 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: CFKMVGJGLGKFKI-UHFFFAOYSA-N

• 2-Mercapto Benzoic Acid

IUPAC Name: 2-sulfanylbenzoic acid | CAS Registry Number: 147-93-3
Synonyms: Thiosalicylic acid, 2-Carboxythiophenol, o-Mercaptobenzoic acid, o-Thiosalicylic acid, 2-Mercaptobenzoic acid, o-Carboxythiophenol, o-Benzoic acid thiol, 2-Sulfanylbenzoic acid, 2-Thiosalicylic acid, Benzoic acid, 2-mercapto-, o-Sulfhydrylbenzoic acid, Salicylic acid, 2-thio-, BENZOIC ACID, O-MERCAPTO-, USAF KF-2, WLN: SHR BVQ, USAF XR-35, USAF EK-T-2805, o-Mercaptobenzoesaeure [German], T33200_ALDRICH, HSDB 2739

Molecular Formula:	C₇H₆O₂S	Molecular Weight:	154.186340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NBOMNTLFRHMDEZ-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:	C₇H₆O₃	Molecular Weight:	138.120740 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: FJKROLUGYXJWQN-UHFFFAOYSA-N

• 2,4,6-Trimethylaniline

IUPAC Name: 2,4,6-trimethylaniline | CAS Registry Number: 88-05-1
Synonyms: Mesidine, Aminomesitylene, Mesitylamine, Mesidin, 2-Aminomesitylene, Mesidin [Czech], Mesitylene, 2-amino-, Aniline, 2,4,6-trimethyl-, 2,4,6-TRIMETHYLANILINE, Benzenamine, 2,4,6-trimethyl-, 2,4,6-Trimethylbenzenamine, CCRIS 2871, HSDB 2694, 2-Amino-1,3,5-trimethylbenzene, 132179_ALDRICH, 92290_FLUKA, EINECS 201-794-3, ZINC01555241, 1-Amino-2,4,6-trimethylbenzen [Czech], LS-20005

Molecular Formula:	C₉H₁₃N	Molecular Weight:	135.206220 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: KWVPRPSXBZNOHS-UHFFFAOYSA-N

• 2-Mercaptopropionic Acid

IUPAC Name: 2-sulfanylpropanoic acid | CAS Registry Number: 79-42-5
Synonyms: Thiolactic acid, 2-Thiolactic acid, 2-Mercaptopropanoic acid, 2-Thiolpropionic acid, 2-Mercaptopropionic acid, alpha-Mercaptopropanoic acid, alpha-Mercaptopropionic acid, 2-Sulfanylpropanoic acid, Propionic acid, 2-mercapto-, FEMA No. 3180, T31003_ALDRICH, W318000_ALDRICH, CHEBI:47872, EINECS 201-206-5, PROPANOIC ACID, 2-MERCAPTO-, UN2936, CID62326, BRN 0506218, Thiolactic acid [UN2936] [Poison], LS-2894

Molecular Formula:	C₃H₆O₂S	Molecular Weight:	106.143540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: PMNLUUOXGOOLSP-UHFFFAOYSA-N

• 2,2-Dichlorodiethyl Ether

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

Molecular Formula:	C₄H₈Cl₂O	Molecular Weight:	143.011720 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: ZNSMNVMLTJELDZ-UHFFFAOYSA-N

• 2-(Hydroxymethyl)pyridine

IUPAC Name: pyridin-2-ylmethanol | CAS Registry Number: 586-98-1
Synonyms: 2-Pyridinylmethanol, 2-Pyridylcarbinol, 2-Pyridylmethanol, 2-PYRIDINEMETHANOL, Piconolum [Latin], Piconol [INN], Pyridine-2-carbinol, alpha-Picolyl alcohol, 2-Pyridyl carbinol, pyridin-2-ylmethanol, .alpha.-Picolyl alcohol, omega-Hydroxy-2-picoline, P66602_ALDRICH, 55770_FLUKA, EINECS 209-592-7, BRN 0107849, SBB004348, ZINC00158585, NCGC00166075-01, LS-131669

Molecular Formula:	C₆H₇NO	Molecular Weight:	109.125880 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: SHNUBALDGXWUJI-UHFFFAOYSA-N

• 2-Methylbutene-2

IUPAC Name: 2-methylbut-2-ene | CAS Registry Number: 513-35-9
Synonyms: Trimethylethylene, 2-Methyl-2-butene, n-Amylene, beta-Isoamylene, b-isoamylene, Methyl butene, 2-Butene, 2-methyl-, 2-Methylbut-2-ene, AMYLENE, 3-Methyl-2-butene, Ethylene, trimethyl-, .beta.-Isoamylene, Amylene (VAN), 1,1,2-Trimethylethylene, 2-Methyl-2-butene solution, M32704_ALDRICH, 304042_ALDRICH, 379263_ALDRICH, 66050_FLUKA, 86262_FLUKA

Molecular Formula:	C₅H₁₀	Molecular Weight:	70.132900 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: BKOOMYPCSUNDGP-UHFFFAOYSA-N

• 3-Bromoaniline

IUPAC Name: 3-bromoaniline | CAS Registry Number: 591-19-5
Synonyms: m-Bromoaniline, Aniline, m-bromo-, 3-BROMOANILINE, Benzenamine, 3-bromo-, m-Aminobromobenzene, 3-Bromobenzenamine, Aniline, m-bromo- (8CI), 180025_ALDRICH, 16210_FLUKA, EINECS 209-704-4, NSC 10298, NSC10298, BRN 0742028, ZINC03861310, LS-28107, ST5213806, TL8003774, 4-12-00-01491 (Beilstein Handbook Reference), InChI=1/C6H6BrN/c7-5-2-1-3-6(8)4-5/h1-4H,8H

Molecular Formula:	C₆H₆BrN	Molecular Weight:	172.022540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DHYHYLGCQVVLOQ-UHFFFAOYSA-N

• 4(N N-Dimethylamine)Pyridine

IUPAC Name: N,N-dimethylpyridin-4-amine | CAS Registry Number: 1122-58-3
Synonyms: dmap, 4-Dimethylaminopyridine, p-Dimethylaminopyridine, 4-(Dimethylamino)pyridine, 4-Pyridinamine, N,N-dimethyl-, Pyridine, 4-(dimethylamino)-, N,N-Dimethylpyridin-4-amine, gamma-(Dimethylamino)pyridine, CCRIS 6176, N,N-DIMETHYL-4-PYRIDINAMINE, 107700_ALDRICH, 522805_ALDRICH, 522821_ALDRICH, 4-DIMETHYLAMINO PYRIDINE, 39405_FLUKA, EINECS 214-353-5, BRN 0110354, N,N-dimethyl-N-(4-pyridinyl)amine, SBB008765, LS-131426

Molecular Formula:	C₇H₁₀N₂	Molecular Weight:	122.167700 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: VHYFNPMBLIVWCW-UHFFFAOYSA-N

• 1,1,1,3,3,3-Hexamethyldisilazane

IUPAC Name: [dimethyl-(trimethylsilylamino)silyl]methane | CAS Registry Number: 999-97-3
Synonyms: Hexamethyldisilazane, Hexamethylsilazane, HMDS, Tri-Sil, Silazane HMN, Bis(trimethylsilyl)amine, HEXAMETHYLSIDILIZANE, Lithium hexamethyldisilazane, N-Lithiohexamethyldisilazane, DISILAZANE,HEXAMETHYL, CCRIS 2456, HSDB 7226, Disilazane, 1,1,1,3,3,3-hexamethyl-, Bis(trimethylsilyl)amidolithium, Dow Corning product Z-6079, Lithiumbis(trimethylsilyl)amine, 379212_ALDRICH, 40215_RIEDEL, 440191_ALDRICH, Bis(trimethylsilyl)amido lithium

Molecular Formula:	C₆H₁₉NSi₂	Molecular Weight:	161.392760 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: FFUAGWLWBBFQJT-UHFFFAOYSA-N

• 2,6-Difluoroaniline

IUPAC Name: 2,6-difluoroaniline | CAS Registry Number: 5509-65-9
Synonyms: Benzenamine, 2,6-difluoro-, 196614_ALDRICH, BB_SC-4594, EINECS 226-853-0, NSC127234, ZINC00159273, D155, TL8003601, InChI=1/C6H5F2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H

Molecular Formula:	C₆H₅F₂N	Molecular Weight:	129.107406 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ODUZJBKKYBQIBX-UHFFFAOYSA-N

• 1-(2-Hydroxy-3-Sulfopropyl) Pyridinium Betaine

IUPAC Name: 2-hydroxy-3-pyridin-1-ium-1-ylpropane-1-sulfonate | CAS Registry Number: 3918-73-8
Synonyms: EINECS 223-485-2, CID107192, 1-(2-Hydroxy-3-sulphonatopropyl)pyridinium, 2-Hydroxy-1-(1-pyridyl)-3-propanesulfonate, Pyridinium, 1-(2-hydroxy-3-sulfopropyl)-, inner salt, 68928-53-0

Molecular Formula:	C₈H₁₁NO₄S	Molecular Weight:	217.242240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: RJPRZHQPROLZRW-UHFFFAOYSA-N

• 2-Amino-4,5-Dimethoxy-Benzoic Acid

IUPAC Name: 2-amino-4,5-dimethoxybenzoic acid | CAS Registry Number: 5653-40-7
Synonyms: 6-Aminoveratric acid, 2-Amino-4,5-dimethoxybenzoic acid, 4,5-Dimethoxyanthranilic acid, 252042_ALDRICH, EINECS 227-095-3, SBB007800, FR-0358, Benzoic acid, 2-amino-4,5-dimethoxy-, TL8003658, InChI=1/C9H11NO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,10H2,1-2H3,(H,11,12

Molecular Formula:	C₉H₁₁NO₄	Molecular Weight:	197.187940 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: HJVAVGOPTDJYOJ-UHFFFAOYSA-N

• 3,5-Diiodosalicylic Acid

IUPAC Name: 2-hydroxy-3,5-diiodobenzoic acid | CAS Registry Number: 133-91-5
Synonyms: 3,5-Diiodosalicylate, 2-Hydroxy-3,5-diiodobenzoic acid, Salicylic acid, 3,5-diiodo-, 3,5-DIIODOSALICYLIC ACID, DIIODOSALICYLIC ACID, 3,5-Diiodo-2-hydroxybenzoic acid, 2-Hydroxy-3,5-diiodobenzoate, Benzoic acid, 2-hydroxy-3,5-diiodo-, WLN: QVR BQ CI EI, D124001_ALDRICH, NSC6303, NSC 6303, EINECS 205-124-0, CID8631, AIDS018052, AIDS-018052, Benzoic acid, 3,5-diiodo-2-hydroxy-, 2-Hydroxy-3,5-diiodobenzenecarboxylic acid, BRN 2615358, STK301498

Molecular Formula:	C₇H₄I₂O₃	Molecular Weight:	389.913800 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: DHZVWQPHNWDCFS-UHFFFAOYSA-N

• 2-Mercapo Ethanol

IUPAC Name: 2-sulfanylethanol | CAS Registry Number: 60-24-2
Synonyms: 2-mercaptoethanol, Mercaptoethanol, Thioglycol, Monothioglycol, Thiomonoglycol, Ethanol, 2-mercapto-, Beta-Mercaptoethanol, Mercaptoetanol, 2-Thioethanol, Thioethylene glycol, 2-Sulfanylethanol, 2-Hydroxyethanethiol, 1-Ethanol-2-thiol, b-mercaptoethanol, Hydroxyethyl mercaptan, Monothioethylene glycol, 2 Mercaptoethanol, Monothioethyleneglycol, 2-Mercapto-1-ethanol, 2-Mercaptoethyl alcohol

Molecular Formula:	C₂H₆OS	Molecular Weight:	78.133440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: DGVVWUTYPXICAM-UHFFFAOYSA-N

• 5-Nitrofurfural Diacetate

IUPAC Name: [acetyloxy-(5-nitrofuran-2-yl)methyl] acetate | CAS Registry Number: 92-55-7
Synonyms: Nitrofuraldehyde diacetate, 5-Nitrofurfural diacetate, 5-Nitro-2-furaldehyde diacetate, 2-(Diacetoxymethyl)-5-nitrofuran, 5-Nitro-2-furfural diacetate, 5-Nitrofurfurylidene diacetate, 5-Nitrofuraldehyde diacetate, Maybridge1_006444, CCRIS 1191, 5-Nitro-2-furanmethanediol diacetate, 5-Nitro-2-furfuraldehyde diacetate, 5-Nitrofurfurylidene di(acetate), 5-Nitro-2-furanmethandiol diacetate, NSC 5411, EINECS 202-166-1, 5-Nitro-2-furancarboxaldehyde diacetate, NSC5411, 5-Nitro-2-furan methandiol diacetate, BRN 0255089, ZINC00056461

Molecular Formula:	C₉H₉NO₇	Molecular Weight:	243.170260 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	7

InChIKey: HSXKWKJCZNRMJO-UHFFFAOYSA-N

• 4-Chloro-3-Sulfamoyl Benzoic Acid

IUPAC Name: 4-chloro-3-sulfamoylbenzoic acid | CAS Registry Number: 1205-30-7
Synonyms: CSBA, 4-Chloro-3-sulfamoylbenzoic acid, Sulfamido-3-chlorobenzoic acid, Oprea1_356117, 4-Chloro-5-sulphamoylbenzoic acid, 293598_ALDRICH, EINECS 214-882-1, CID14568, BRN 2118346, Benzoic acid, 3-(aminosulfonyl)-4-chloro-, BENZOIC ACID, 4-CHLORO-3-SULFAMOYL-, LS-36653, TL806358, ST5319885

Molecular Formula:	C₇H₆ClNO₄S	Molecular Weight:	235.644840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	5

InChIKey: FHQAWINGVCDTTG-UHFFFAOYSA-N

• 1-Naphthaldehyde

IUPAC Name: naphthalene-1-carbaldehyde | CAS Registry Number: 66-77-3
Synonyms: alpha-Naphthal, 1-Formylnaphthalene, 1-Naphthylaldehyde, Naphthaldehyde, alpha-Naphthaldehyde, I-Napthaldehyde, .alpha.-Naphthal, alpha-Naphthylaldehyde, 1-NAPHTHALENECARBOXALDEHYDE, .alpha.-Naphthaldehyde, alpha-Naphthylcarboxaldehyde, .alpha.-Naphthylaldehyde, N109_ALDRICH, .alpha.-Naphthylcarboxaldehyde, 1-NAPHTHALDEHYDE, REAG, NAPHTHALENECARBOXALDEHYDE, NSC 6106, 70180_FLUKA, EINECS 200-633-4, NSC6106

Molecular Formula:	C₁₁H₈O	Molecular Weight:	156.180620 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: SQAINHDHICKHLX-UHFFFAOYSA-N

• 2-Methylresorcinol

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

Molecular Formula:	C₇H₈O₂	Molecular Weight:	124.137220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZTMADXFOCUXMJE-UHFFFAOYSA-N

• 1-Hexadecanol

IUPAC Name: hexadecan-1-ol | CAS Registry Number: 36653-82-4
Synonyms: cetyl alcohol, Palmityl alcohol, Cetanol, Hexadecan-1-ol, n-Cetyl alcohol, Cetaffine, Cetylol, Cetal, Ethal, Ethol, Cetylic alcohol, n-1-Hexadecanol, HEXADECANOL, N-Hexadecanol, Loxanwachs SK, Crodacol C, Hyfatol, Loxanol K extra, Hexadecyl alcohol, Elfacos C

Molecular Formula:	C₁₆H₃₄O	Molecular Weight:	242.440560 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: BXWNKGSJHAJOGX-UHFFFAOYSA-N

• 3,5-Dinitrosalicylic acid

IUPAC Name: 2-hydroxy-3,5-dinitrobenzoic acid | CAS Registry Number: 609-99-4
Synonyms: 3,5-Dinitrosalicylate, 3,5-DINITROSALICYLIC ACID, Salicylic acid, 3,5-dinitro-, Benzoic acid, 2-hydroxy-3,5-dinitro-, 2-Hydroxy-3,5-dinitrobenzoic acid, 3,5-Dinitro-2-hydroxybenzoic acid, Oprea1_730607, D0550_SIGMA, NSC 181, 128848_ALDRICH, NSC181, EINECS 210-204-3, BRN 2220661, AI3-15341, NCGC00166042-01, LS-144323, ST5308508, TL8003862, BENZOIC ACID,3,5-DINITRO,2-HYDROXY, C11319

Molecular Formula:	C₇H₄N₂O₇	Molecular Weight:	228.115860 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	7

InChIKey: LWFUFLREGJMOIZ-UHFFFAOYSA-N

• 3-Amino-2-Chloropyridine

IUPAC Name: 2-chloropyridin-3-amine | CAS Registry Number: 6298-19-7
Synonyms: 3-Amino-2-chloropyridine, 3-Pyridinamine, 2-chloro-, 2-Chloro-3-pyridinamine, 2-Chloro-3-pyridylamine, 2-Chloro-3-aminopyridine, A46900_ALDRICH, Pyridine, 2-chloro-3-amino-, Pyridine, 3-amino-2-chloro-, 07540_FLUKA, NSC45407, EINECS 228-572-9, SBB004233, ZINC00164466, A104, TL8004343, InChI=1/C5H5ClN2/c6-5-4(7)2-1-3-8-5/h1-3H,7H

Molecular Formula:	C₅H₅ClN₂	Molecular Weight:	128.559600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: MEQBJJUWDCYIAB-UHFFFAOYSA-N

• 4-Chloro-1,3-dioxolan-2-one

IUPAC Name: 4-chloro-1,3-dioxolan-2-one | CAS Registry Number: 3967-54-2
Synonyms: Chloroethylene carbonate, Chloroethyleneglycol carbonate, 1,3-Dioxolan-2-one, 4-chloro-, 167630_ALDRICH, NSC74446, 24481_FLUKA, AIDS125494, AIDS-125494, CID98075, EINECS 223-583-5, NSC 74446

Molecular Formula:	C₃H₃ClO₃	Molecular Weight:	122.507120 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: OYOKPDLAMOMTEE-UHFFFAOYSA-N

• 1,4-Dioxane

IUPAC Name: 1,4-dioxane | CAS Registry Number: 123-91-1
Synonyms: p-Dioxane, Dioxane, Dioxan, Diethylene ether, 1,4-DIOXANE, Diethylene oxide, Diokan, Di(ethylene oxide), Tetrahydro-p-dioxin, Diethylene dioxide, para-Dioxane, Dioxyethylene ether, 1,4-Diethylene dioxide, Dioxane-1,4, Dioxanne, Glycolethylenether, Dioksan, Glycol ethylene ether, Diox, :dioxane

Molecular Formula:	C₄H₈O₂	Molecular Weight:	88.105120 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: RYHBNJHYFVUHQT-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzaldehyde

IUPAC Name: 3,4,5-trimethoxybenzaldehyde | CAS Registry Number: 86-81-7
Synonyms: 3,4,5-TRIMETHOXYBENZALDEHYDE, Benzaldehyde, 3,4,5-trimethoxy-, T68403_ALDRICH, 92140_FLUKA, EINECS 201-701-6, BENZALDEHYDE,3,4,5-TRIMETHOXY-, NSC 16692, AIDS017928, AIDS-017928, NSC16692, BRN 0395163, SBB016338, ZINC02504375, AI3-36673, LS-25170, TL8005630, 4-08-00-02719 (Beilstein Handbook Reference), InChI=1/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H

Molecular Formula:	C₁₀H₁₂O₄	Molecular Weight:	196.199880 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	4

InChIKey: OPHQOIGEOHXOGX-UHFFFAOYSA-N

• 1-Decanol

IUPAC Name: decan-1-ol | CAS Registry Number: 112-30-1
Synonyms: n-Decanol, 1-DECANOL, n-Decyl alcohol, Decyl alcohol, Nonylcarbinol, Capric alcohol, Caprinic alcohol, Royaltac, Decanol, Antak, Decan-1-ol, n-Nonylcarbinol, n-Decatyl alcohol, n-Decan-1-ol, 1-Hydroxydecane, Sprout-Off, Alcohol C-10, Contak, Delete, Decylic alcohol

Molecular Formula:	C₁₀H₂₂O	Molecular Weight:	158.281080 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: MWKFXSUHUHTGQN-UHFFFAOYSA-N

• 1,1,2,2-Tetrachloroethane

IUPAC Name: 1,1,2,2-tetrachloroethane | CAS Registry Number: 79-34-5
Synonyms: s-Tetrachloroethane, Bonoform, Cellon, Tetrachlorethane, Tetrachloroethane, Acetosal, Westron, Acetylene tetrachloride, Acetosol, TCE (ambiguous), sym-Tetrachloroethane, Caswell No. 826, 1,1,2,2-TETRACHLOROETHANE, Ethane, 1,1,2,2-tetrachloro-, Tetrachloroethane (VAN), RCRA waste no. U209, WLN: GYGYGG, RCRA waste number U209, Tetrachlorure d'acetylene, 1,1,2,2-Tetrachloraethan

Molecular Formula:	C₂H₂Cl₄	Molecular Weight:	167.849280 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: QPFMBZIOSGYJDE-UHFFFAOYSA-N

• 5-Phenyltetrazole

IUPAC Name: 5-phenyl-2H-tetrazole | CAS Registry Number: 18039-42-4
Synonyms: Phenyltetrazole, 5-Phenyl tetrazole, Expandex 5PT, Expandex OX 5PT, 5-Phenyl-2H-tetrazole, Kempore 50XPT, 1H-Tetrazole, 5-phenyl-, 5-Phenyl-1H-tetrazole, 2H-Tetrazole, 5-phenyl-, Tetrazole, 5-phenyl-, 5-Phenyltetrazole (VAN), 5-phenyl-2H-tetraazole, Enamine_005030, MA 1623, MLS000779707, 347744_ALDRICH, Tetrazole, 5-phenyl- (6CI), EINECS 241-950-8, NSC 11138, AIDS084282

Molecular Formula:	C₇H₆N₄	Molecular Weight:	146.149340 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: MARUHZGHZWCEQU-UHFFFAOYSA-N

• 4-Aminopyridine

IUPAC Name: pyridin-4-amine | CAS Registry Number: 504-24-5
Synonyms: 4-aminopyridine, 4-Pyridinamine, Fampridine, Avitrol, 4-Pyridylamine, p-Aminopyridine, Fampridine-SR, Neurelan, Pymadine, pyridin-4-amine, Pyridine, 4-amino-, Amino-4 pyridine, gamma-Aminopyridine, Aminopyridine, Ampydin, Pymadin, 4 Aminopyridine, Avitrol 200, Fampridine SR, Pimadin (free base)

Molecular Formula:	C₅H₆N₂	Molecular Weight:	94.114540 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: NUKYPUAOHBNCPY-UHFFFAOYSA-N

• 4-Methylcatechol

IUPAC Name: 4-methylbenzene-1,2-diol | CAS Registry Number: 452-86-8
Synonyms: Homocatechol, 3,4-Dihydroxytoluene, Homopyrocatechol, p-Methylcatechol, p-Methylpyrocatechol, 4-Methyl-1,2-benzenediol, Toluene-3,4-diol, 4-methylbenzene-1,2-diol, 4-METHYLPYROCATECHOL, Pyrocatechol, 4-methyl-, 1,2-Benzenediol, 4-methyl-, 1,2-Dihydroxy-4-methylbenzene, Ambap4371, 4-Methyl-1,2-dihydroxybenzene, CCRIS 3333, M34200_ALDRICH, MLS001066329, C7H8O2, 53480_FLUKA, CHEBI:17254

Molecular Formula:	C₇H₈O₂	Molecular Weight:	124.137220 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	2

InChIKey: ZBCATMYQYDCTIZ-UHFFFAOYSA-N

• 2-Mercapto Pyrimidine

IUPAC Name: 1H-pyrimidine-2-thione | CAS Registry Number: 1450-85-7
Synonyms: 2-Thiopyrimidine, 2-Mercaptopyrimidine, 2-Pyrimidinethiol, Pyrimidine-2-thiol, 2-Pyrimidinethione, Pyrimidine-1-thiol, 2(1H)-Pyrimidinethione, 129623_ALDRICH, AIDS023055, AIDS-023055, NSC48073, EINECS 215-917-3, EINECS 258-741-2, NSC193522, SBB007595, ZINC01649580, ZINC02008823, 19351-11-2 (DELETED), 107646-94-6 (DELETED), InChI=1/C4H4N2S/c7-4-5-2-1-3-6-4/h1-3H,(H,5,6,7

Molecular Formula:	C₄H₄N₂S	Molecular Weight:	112.152960 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	0

InChIKey: HBCQSNAFLVXVAY-UHFFFAOYSA-N

• 2,4-Dimethyl-6-Tert butyl Phenol

IUPAC Name: 2-tert-butyl-4,6-dimethylphenol | CAS Registry Number: 1879-09-0
Synonyms: Topanol A, Prodox 340, 6-tert-Butyl-2,4-dimethylphenol, 6-tert-Butyl-2,4-xylenol, 2,4-Dimethyl-6-tert-butylphenol, 6-t-Butyl-2,4-xylenol, 2,4-Xylenol, 6-tert-butyl-, 2-tert-Butyl-4,6-dimethylphenol, 6-t-Butyl-2,4-dimethylphenol, NSC 8130, EINECS 217-533-1, NSC8130, CID15884, BRN 1941702, ZINC01586423, Phenol, 2-(1,1-dimethylethyl)-4,6-dimethyl-, WLN: QR B1 D1 F1X1&1&1, SB 01223, LS-162625, 4-06-00-03442 (Beilstein Handbook Reference)

Molecular Formula:	C₁₂H₁₈O	Molecular Weight:	178.270720 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: OPLCSTZDXXUYDU-UHFFFAOYSA-N

• 4-Bromophenol

IUPAC Name: 4-bromophenol | CAS Registry Number: 106-41-2
Synonyms: p-Bromophenol, 4-BROMOPHENOL, Phenol, 4-bromo-, Phenol, p-bromo-, p-Bromophenic acid, p-Bromohydroxybenzene, CCRIS 632, B75808_ALDRICH, 442405_SUPELCO, NSC 4970, EINECS 203-394-4, NSC4970, AIDS017751, AIDS-017751, ZINC00404316, AI3-14903, TL806339, LS-104088, ST5214520, C14453

Molecular Formula:	C₆H₅BrO	Molecular Weight:	173.007300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: GZFGOTFRPZRKDS-UHFFFAOYSA-N

• 2,4,5-Trichloroaniline

IUPAC Name: 2,4,5-trichloroaniline | CAS Registry Number: 636-30-6
Synonyms: 2,4,5-TRICHLOROANILINE, Aniline, 2,4,5-trichloro-, Benzenamine, 2,4,5-trichloro-, T54003_ALDRICH, 35828_RIEDEL, CCRIS 2882, NSC64139, 91140_FLUKA, CID12487, EINECS 211-254-9, NSC 64139, SBB003585, ZINC00391971, Aniline, 2,4,5-trichloro- (8CI), TL8004450, InChI=1/C6H4Cl3N/c7-3-1-5(9)6(10)2-4(3)8/h1-2H,10H

Molecular Formula:	C₆H₄Cl₃N	Molecular Weight:	196.461660 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: GUMCAKKKNKYFEB-UHFFFAOYSA-N

• 3-Amino-5-methylisoxazole

IUPAC Name: 5-methyl-1,2-oxazol-3-amine | CAS Registry Number: 1072-67-9
Synonyms: 5-Methyl-3-isoxazolamine, 3-Isoxazolamine, 5-methyl-, 3-Methyl-5-aminoisoxazole, 5-Methyl-3-aminoisoxazole, Isoxazole, 3-amino-5-methyl-, 5-Methylisoxazol-3-ylamine, 5-methylisoxazol-3-amine, 232270_ALDRICH, EINECS 214-013-6, NSC159134, NSC 159134, 3-AMINO-5-METHYL ISOXAZOLE, CID66172, SBB005553, ZINC01610351, AI3-62721, Isoxazole, 3-amino-5-methyl- (8CI), SDCCGMLS-0066220.P001, LS-195291, InChI=1/C4H6N2O/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6

Molecular Formula:	C₄H₆N₂O	Molecular Weight:	98.103240 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: FKPXGNGUVSHWQQ-UHFFFAOYSA-N

• 1,3,5-Benzenetricarbonyl Trichloride

IUPAC Name: benzene-1,3,5-tricarbonyl chloride | CAS Registry Number: 4422-95-1
Synonyms: Trimesoyl chloride, Trimesic acid trichloride, 1,3,5-Benzenetricarbonyl trichloride, 147532_ALDRICH, 1,3,5-Benzenetricarbonyl chloride, 92132_FLUKA, 1,3,5-Benzenetricarboxylic chloride, NSC82328, Benzene-1,3,5-tricarbonyl chloride, EINECS 224-594-8, NSC 82328, 1,3,5-Benzenetricarboxylic acid chloride, 84270-84-8

Molecular Formula:	C₉H₃Cl₃O₃	Molecular Weight:	265.477320 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: UWCPYKQBIPYOLX-UHFFFAOYSA-N

• 5-Methyluridine

IUPAC Name: 1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione | CAS Registry Number: 1463-10-1
Synonyms: Ribothymidine, Thymine riboside, Ambap220, Uridine, 5-methyl-, nchembio.2007.30-comp3d, 5MU-5MU-5MU, M8905_SIGMA, 535893_ALDRICH, CHEBI:30821, AIDS184529, AIDS-184529, EINECS 215-973-9, ZINC02583634, 5-METHYLURIDINE 5'-MONOPHOSPHATE, TL8001022, 1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione, 1-[(4S,2R,3R,5R)-3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-1,3-dihydropyrimidine-2,4-dione, 5MU, 849658-09-9

Molecular Formula:	C₁₀H₁₄N₂O₆	Molecular Weight:	258.227960 [g/mol]
H-Bond Donor:	4	H-Bond Acceptor:	6

InChIKey: DWRXFEITVBNRMK-JXOAFFINSA-N