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• 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-Chlorobenzhydrylchloride

IUPAC Name: 1-chloro-4-[chloro(phenyl)methyl]benzene | CAS Registry Number: 134-83-8
Synonyms: 4-Chlorobenzhydryl chloride, p-Chlorobenzhydryl chloride, 103314_ALDRICH, Methane, chloro(p-chlorophenyl)phenyl-, Chloro(p-chlorophenyl)phenylmethane, Chloro(4-chlorophenyl)phenylmethane, NSC49126, Benzene, 1-chloro-4-(chlorophenylmethyl)-

Molecular Formula:	C₁₃H₁₀Cl₂	Molecular Weight:	237.124500 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: ALKWTKGPKKAZMN-UHFFFAOYSA-N

• 2-Methyl-4,5,6,7-Tetrahydro-1H-Indol-4-One

IUPAC Name: 2-methyl-1,5,6,7-tetrahydroindol-4-one | CAS Registry Number: 35308-68-0
Synonyms: 1,5,6,7-Tetrahydro-2-methyl-4H-indol-4-one, 2-Methyl-4,5,6,7-tetrahydro-1H-indol-4-one, AG-F-22068, 2-Methyl-4-oxo-4,5,6,7-tetrahydroindole, 2-methyl-6,7-dihydro-1H-indol-4(5H)-one, SureCN1052949, SureCN6753719, ACMC-1AE11, CTK4H4216, HJIYEKHYUGHTAC-UHFFFAOYSA-, MolPort-006-013-041, ANW-28171, ZINC02540011, AKOS000320271, AB21142, AC-13113, AK-28630, KB-173690, 2-methyl-1,5,6,7-tetrahydro-indol-4-one, FT-0649545

Molecular Formula:	C₉H₁₁NO	Molecular Weight:	149.189740 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: HJIYEKHYUGHTAC-UHFFFAOYSA-N

• 2,4-Dichlorobenzotrichloride

IUPAC Name: 2,4-dichloro-1-(trichloromethyl)benzene | CAS Registry Number: 13014-18-1
Synonyms: CCRIS 6087, 2,4-Dichlorophenyltrichloromethane, 2,4,A,A,A-PENTACHLOROTOLUENE, MLS002415690, 2, 4-Dichlorobenzotrichloride, Benzene, 2,4-dichloro-1-(trichloromethyl)-, EINECS 235-868-1, 1,3-Dichloro-4-(trichloromethyl)benzene, 2,4-Dichloro-1-(trichloromethyl)benzene, NSC 403840, CID25607, BRN 0514239, LS-729, NSC403840, 2,4,alpha,alpha,alpha-Pentachlorotoluene, alpha,alpha,alpha,2,4-Pentachlorotoluene, AI3-02376, 2,4-alpha,alpha,alpha-Pentachlorotoluene, NCGC00091827-01, Toluene, alpha,alpha,alpha,2,4-pentachloro-

Molecular Formula:	C₇H₃Cl₅	Molecular Weight:	264.363720 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: KZSNBJMYJWDVTK-UHFFFAOYSA-N

• 3-Trifluoromethyl Benzyl Bromide

IUPAC Name: 1-(bromomethyl)-3-(trifluoromethyl)benzene | CAS Registry Number: 402-23-3
Synonyms: m-Trifluoromethylbenzyl bromide, 3-Trifluoromethylbenzyl bromide, 3-Trifluoromethylbenzylbromide, 3-(Trifluoromethyl)benzyl bromide, 290556_ALDRICH, JRD-0053, EINECS 206-938-9, CID123061, SBB006697, 1-(Bromomethyl)-3-(trifluoromethyl)benzene, TL8002857, alpha'-Bromo-alpha,alpha,alpha-trifluoro-m-xylene

Molecular Formula:	C₈H₆BrF₃	Molecular Weight:	239.032450 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: MYYYZNVAUZVXBO-UHFFFAOYSA-N

• 5,6-Dimethyl Benzimidazole

IUPAC Name: 5,6-dimethyl-1H-benzimidazole | CAS Registry Number: 582-60-5
Synonyms: Dimedazole, Dimedazol, Dimesol, Dimezol, 5,6-Dimethylbenzimidazole, dimethylbenzimidazole, Dimezol base, nchembio.67-comp7, Benzimidazole, 5,6-dimethyl-, 5,6-Dimethyl-1H-benzimidazole, 1H-Benzimidazole, 5,6-dimethyl-, D147206_ALDRICH, ARONIS001284, 39580_FLUKA, CHEBI:15890, EINECS 209-488-1, NSC 68316, NSC68316, BRN 0116595, SBB004105

Molecular Formula:	C₉H₁₀N₂	Molecular Weight:	146.189100 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: LJUQGASMPRMWIW-UHFFFAOYSA-N

• 2-Phenyl-4-nitro-anisole

IUPAC Name: 1-methoxy-4-nitro-2-phenylbenzene | CAS Registry Number: 15854-75-8
Synonyms: 2-phenyl-4-nitroanisol, 1-methoxy-4-nitro-2-phenylbenzene, 2-Phenyl-4-nitro-anisol, 2-Methoxy-5-nitro-1,1'-biphenyl, 2-Methoxy-5-nitro-biphenyl, SureCN10933113, AC1O50M3, CTK4C9730, 2-METHOXY-5-NITROBIPHENYL, 1-methoxy-4-nitro-2-phenyl-benzene, SBB063894, ZINC02513834, 1,1'-Biphenyl,2-methoxy-5-nitro-, AKOS015889762, AB16539, AG-E-07692, AC-12226, AK-33491, KB-25906, FT-0637284

Molecular Formula:	C₁₃H₁₁NO₃	Molecular Weight:	229.231340 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: DFVBQSMLKLCRCB-UHFFFAOYSA-N

• 1-Acetyl-4-(4-Hydroxyphenyl)-Piperazine

IUPAC Name: 1-[4-(4-hydroxyphenyl)piperazin-1-yl]ethanone | CAS Registry Number: 67914-60-7
Synonyms: Oprea1_786576, 511943_ALDRICH, 1-Acetyl-4-(4-hydroxyphenyl)piperazine, ZINC00105363, EINECS 267-744-8, CID712441, SBB003353, SDCCGMLS-0066236.P001, TL8004782

Molecular Formula:	C₁₂H₁₆N₂O₂	Molecular Weight:	220.267640 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: AGVNLFCRZULMKK-UHFFFAOYSA-N

• 1-benzylpiperazine

IUPAC Name: 1-(phenylmethyl)piperazine | CAS Registry Number: 2759-28-6
Synonyms: 1-Benzylpiperazine, N-benzylpiperazine, Benzylpiperazine, 4-Benzylpiperazine, Piperazine, 1-benzyl-, nchembio814-comp10, 1-(phenylmethyl)piperazine, Piperazine, polymer-bound, Piperazine, 1-(phenylmethyl)-, 526290_ALDRICH, 547549_ALDRICH, Piperazine, 1-benzyl- (8CI), 13815_FLUKA, EINECS 220-423-6, 1-Benzylpiperazine dihydrochloride, NSC 40889, NSC40889, EINECS 226-188-6, SBB007534, AI3-52573

Molecular Formula:	C₁₁H₁₆N₂	Molecular Weight:	176.258140 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	2

InChIKey: IQXXEPZFOOTTBA-UHFFFAOYSA-N

• 1-Benzylpiperidine-4-Carboxylic Acid

IUPAC Name: 1-benzylpiperidine-4-carboxylic acid | CAS Registry Number: 10315-07-8
Synonyms: 1-benzylpiperidine-4-carboxylic acid, 1-Benzyl-Isonipecotic Acid, 1-Benzylpiperidine-4-CarboxylicAcid, SBB053307, 1-Benzyl-piperidine-4-carboxylic acid, AC1NFWEX, BZL-INP-OH, AC1Q74NX, AC1Q74NY, SureCN1519223, BZL-ISONIPECOTIC ACID, CTK0H4273, N-BENZYL-ISONIPECOTIC ACID, MolPort-000-002-424, ACN-S002917, 1-BENZYL-4-CARBOXYPIPERIDINE, ANW-59886, STK354950, AKOS000125168, AB14004

Molecular Formula:	C₁₃H₁₇NO₂	Molecular Weight:	219.279580 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZMVSVQMWFTZSJQ-UHFFFAOYSA-N

• 4-Amino-2-Chloro-6,7-Dimethoxy Quinazoline

IUPAC Name: 2-chloro-6,7-dimethoxyquinazolin-4-amine | CAS Registry Number: 23680-84-4
Synonyms: 518654_ALDRICH, 4-Amino-2-chloro-6,7-dimethoxyquinazoline, ZINC02028665, ALBB-005949, CID90235, EINECS 245-821-7, SBB000787, 2-Chloro-6,7-dimethoxy-4-quinazolinamine, 2-Chloro-6,7-dimethoxyquinazolin-4-amine, 4-Quinazolinamine, 2-chloro-6,7-dimethoxy-, 2-chloro-6,7-dimethoxyquinazolin-4-ylamine, TL8001956, AN-829/25042011

Molecular Formula:	C₁₀H₁₀ClN₃O₂	Molecular Weight:	239.658300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: HWIIAAVGRHKSOJ-UHFFFAOYSA-N

• 2-Chloro-6-Fluorobenzyl Chloride

IUPAC Name: 1-chloro-2-(chloromethyl)-3-fluorobenzene | CAS Registry Number: 55117-15-2
Synonyms: 2-Chloro-6-fluorobenzyl chloride, 218111_ALDRICH, 2,alpha-Dichloro-6-fluorotoluene, alpha,2-Dichloro-6-fluorotoluene, EINECS 259-487-5, Benzene, 1-chloro-2-(chloromethyl)-3-fluoro-, 1-Chloro-2-(chloromethyl)-3-fluorobenzene, ST5214141, 3S210934

Molecular Formula:	C₇H₅Cl₂F	Molecular Weight:	179.019003 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: MJGOLNNLNQQIHR-UHFFFAOYSA-N

• 2-Amino-5-chlorobenzoic acid

IUPAC Name: 2-amino-5-chlorobenzoic acid | CAS Registry Number: 635-21-2
Synonyms: 5-Chloroanthranilic acid, Anthranilic acid, 5-chloro-, Benzoic acid, 2-amino-5-chloro-, 2-AMINO-5-CHLOROBENZOIC ACID, 5-Chloro-2-aminobenzoic acid, A45475_ALDRICH, 378046_ALDRICH, 07360_FLUKA, AIDS020040, AIDS-020040, EINECS 211-230-8, NSC404157, SBB016392, Anthranilic acid, 5-chloro- (8CI), NSC 404157, AI3-15229, TL8004430, InChI=1/C7H6ClNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula:	C₇H₆ClNO₂	Molecular Weight:	171.581040 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: IFXKXCLVKQVVDI-UHFFFAOYSA-N

• 4-(Chloromethyl)benzoic acid methyl ester

IUPAC Name: methyl 4-(chloromethyl)benzoate | CAS Registry Number: 34040-64-7
Synonyms: EINECS 251-806-6, ZINC02009882, METHYL 4-(CHLOROMETHYL)BENZOATE, p-Toluic acid, .alpha.-chloro-, methyl ester, Benzoic acid, 4-(chloromethyl)-, methyl ester

Molecular Formula:	C₉H₉ClO₂	Molecular Weight:	184.619560 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	2

InChIKey: SATDLKYRVXFXRE-UHFFFAOYSA-N

• 1,3,5-Trifluoro Benzene

IUPAC Name: 1,3,5-trifluorobenzene | CAS Registry Number: 372-38-3
Synonyms: sym-Trifluorobenzene, 1,3,5-TRIFLUOROBENZENE, Benzene, 1,3,5-trifluoro-, 1,3,5-Trifluoro-benzene, 196851_ALDRICH, CID9745, 1,3,5-TRIFLUORO BENZENE, JRD-0247, NSC10264, EINECS 206-751-2, ZINC00164868, SB 01896, TL8002744, 3S210982

Molecular Formula:	C₆H₃F₃	Molecular Weight:	132.083230 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: JXUKFFRPLNTYIV-UHFFFAOYSA-N

• 2-Thiophene Carboxaldehyde

IUPAC Name: thiophene-2-carbaldehyde | CAS Registry Number: 98-03-3
Synonyms: 2-Thienylaldehyde, 2-Thiophenecarboxaldehyde, 2-Thienaldehyde, Thenaldehyde, 2-Thiophenealdehyde, alpha-Formylthiophene, 2-Thienylcarboxaldehyde, .alpha.-Formylthiophene, Thiophene-2-carbaldehyde, 2-FORMYLTHIOPHENE, 2-Thiophenecarbaldehyde, alpha-Thiophenecarboxaldehyde, WLN: T5SJ BVH, T32409_ALDRICH, .alpha.-Thiophenecarboxaldehyde, NSC 2162, EINECS 202-629-8, NSC2162, SBB004321, ZINC00158751

Molecular Formula:	C₅H₄OS	Molecular Weight:	112.149660 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: CNUDBTRUORMMPA-UHFFFAOYSA-N

• 2,5-Dimethyl-3-hydroxybenzoic acid

IUPAC Name: 3-hydroxy-2,5-dimethylbenzoic acid | CAS Registry Number: 27023-06-9
Synonyms: NSC106546, CID267354

Molecular Formula:	C₉H₁₀O₃	Molecular Weight:	166.173900 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: TUWYDGRWPNEWNJ-UHFFFAOYSA-N

• 4-Chlorobenzophenone

IUPAC Name: (4-chlorophenyl)-phenylmethanone | CAS Registry Number: 134-85-0
Synonyms: p-Chlorobenzophenone, Benzophenone, 4-chloro-, p-CBP, 4-CHLOROBENZOPHENONE, para-Chlorobenzophenone, Methanone, (4-chlorophenyl)phenyl-, C25007_ALDRICH, HSDB 2740, Benzophenone, 4-chloro- (8CI), NSC2872, (4-Chlorophenyl)(phenyl)methanone, NSC 2872, EINECS 205-160-7, ZINC01594470, AI3-00705, ST5308103, TL8000816

Molecular Formula:	C₁₃H₉ClO	Molecular Weight:	216.662960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: UGVRJVHOJNYEHR-UHFFFAOYSA-N

• (S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid hydrochloride

IUPAC Name: (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid | CAS Registry Number: 74163-81-8
Synonyms: 421626_ALDRICH, 87437_FLUKA, AL081-1, ST5330564, L-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid, (S)-1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid

Molecular Formula:	C₁₀H₁₁NO₂	Molecular Weight:	177.199840 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: BWKMGYQJPOAASG-VIFPVBQESA-N

• 5-Amino Isophthalic Acid

IUPAC Name: 5-aminobenzene-1,3-dicarboxylic acid | CAS Registry Number: 99-31-0
Synonyms: 5-Aminoisophthalic acid, Isophthalic acid, 5-amino-, Oprea1_005424, 186279_ALDRICH, NSC60141, 1,3-Benzenedicarboxylic acid, 5-amino-, CID66833, EINECS 202-748-5, Isophthalic acid, 5-amino- (8CI), NSC 60141, 5-Aminobenzene-1,3-dicarboxylic acid, ST5308594, 5-AMINO-1,3-BENZENEDICARBOXYLIC ACID

Molecular Formula:	C₈H₇NO₄	Molecular Weight:	181.145480 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: KBZFDRWPMZESDI-UHFFFAOYSA-N

• 4-Methyl Phenyl Acetonitrile

IUPAC Name: 2-(4-methylphenyl)acetonitrile | CAS Registry Number: 2947-61-7
Synonyms: p-Tolylacetonitrile, 4-Methylbenzyl cyanide, p-Methylbenzyl cyanide, alpha-Cyano-p-xylene, 4-Methylphenylacetonitrile, 4-Methylbenzeneacetonitrile, Benzeneacetonitrile, 4-methyl-, (4-methylphenyl)acetonitrile, M31651_ALDRICH, EINECS 220-963-2, ZINC02242671, BBV-052792

Molecular Formula:	C₉H₉N	Molecular Weight:	131.174460 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: RNHKXHKUKJXLAU-UHFFFAOYSA-N

• 5-Hydroxyisophthalic Acid

IUPAC Name: 5-hydroxybenzene-1,3-dicarboxylic acid | CAS Registry Number: 618-83-7
Synonyms: 5-Hydroxyisophthalic acid, 5-Oxyisophthalic acid, 5-Hydroxyisosphthalic acid, Isophthalic acid, 5-hydroxy-, 311278_ALDRICH, 1,3-Benzenedicarboxylic acid, 5-hydroxy-, EINECS 210-565-7, NSC 302088, 5-Hydroxy-1,3-benzenedicarboxylic acid, BRN 2693561, NSC302088, LS-29776, Isophthalic acid, 5-hydroxy- (6CI,7CI,8CI), ST5307230, TL8003969, 4-10-00-02098 (Beilstein Handbook Reference)

Molecular Formula:	C₈H₆O₅	Molecular Weight:	182.130240 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	5

InChIKey: QNVNLUSHGRBCLO-UHFFFAOYSA-N

• (S)-(+)-2,2-Dimethyl-1,3-dioxolane-4-methanol

IUPAC Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methanol | CAS Registry Number: 22323-82-6
Synonyms: Solketal, Glycerolacetone, Dioxolan, Acetone glycerol, Glycerol dimethylketal, Isopropylidene glycerol, Glycerol acetonide, DIOXOLANE, D-Acetone glycerol, Acetone monoglycerol ketal, Ambap651, Glycerinisopropylidene ether, 1,2-Isopropylideneglycerin, 1,2-Isopropylideneglycerol, 2,3-Isopropylideneglycerol, Glycerol acetonide (VAN), 1,2-O-Isopropylideneglycerol, 1,2-O,O-Isopropylideneglycerin, Glycerol, 1,2-O-isopropylidene, 2,3-(Isopropylidenedioxy)propanol

Molecular Formula:	C₆H₁₂O₃	Molecular Weight:	132.157680 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: RNVYQYLELCKWAN-UHFFFAOYSA-N

• [4-(4-Methoxypiperazine-1-yl)phenyl] carbamic acid phenyl ester

IUPAC Name: phenyl N-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]carbamate | CAS Registry Number: 74853-06-8
Synonyms: ST094974, 4-{[4-(4-Methyloxy-phenyl)-piperazin-1-yl]-phenyl}-carbamic Acid Phenyl Ester, AC1LJXJI, SureCN2543995, CTK8F5578, Phenyl N-[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]carbamate, ZINC00626955, AG-G-97875, MCULE-7569935809, FT-0671346, N-{4-[4-(4-methoxyphenyl)piperazinyl]phenyl}phenoxycarboxamide, [4-[4-(4-Methoxyphenyl)-1-piperazinyl]phenyl]carbamic Acid Phenyl Ester, Carbamicacid, [4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]-, phenyl ester (9CI)

Molecular Formula:	C₂₄H₂₅N₃O₃	Molecular Weight:	403.473600 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: NTGBUUXKGAZMSE-UHFFFAOYSA-N

• 3-Amino-4-Methoxybenzamide

IUPAC Name: 3-amino-4-methoxybenzamide | CAS Registry Number: 17481-27-5
Synonyms: 3-Amino-p-anisamide, 3-Amino-4-methoxybenzamide, Oprea1_735966, MLS000105652, Benzamide, 3-amino-4-methoxy-, EINECS 241-497-6, ZINC00296138, SDCCGMLS-0006111.P002, SMR000102630, ST5406925

Molecular Formula:	C₈H₁₀N₂O₂	Molecular Weight:	166.177200 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: INCJNDAQNPWMPZ-UHFFFAOYSA-N

• 5-Nitro-1,2,3-benzenetricarboxylic acid

IUPAC Name: 5-nitrobenzene-1,2,3-tricarboxylic acid | CAS Registry Number: 3807-81-6
Synonyms: 1-Nitrobenzene-3,4,5-tricarboxylic acid, 5-Nitro-1,2,3-benzenetricarboxylicacid, 5-nitrobenzene-1,2,3-tricarboxylic acid, 5-nitro-benzene-1,2,3-tricarboxylic acid, SureCN11317378, AGN-PC-001EW8, CTK1C2388, MolPort-002-499-950, ACN-S004358, SBB063476, Hemimelliticacid, 5-nitro- (6CI);, AKOS015889432, AB16337, AG-F-34093, RP29094, AC-12653, AK-23839, Q805, 1,2,3-Benzenetricarboxylicacid, 5-nitro-, KB-198099

Molecular Formula:	C₉H₅NO₈	Molecular Weight:	255.137900 [g/mol]
H-Bond Donor:	3	H-Bond Acceptor:	8

InChIKey: KIRNHRJGEAFKPM-UHFFFAOYSA-N

• 2-Amino-4-Chloro-6-NitroPhenol

IUPAC Name: 2-amino-4-chloro-6-nitrophenol | CAS Registry Number: 6358-08-3
Synonyms: 530387_ALDRICH, EINECS 228-761-6, 2-Amino-4-Chloro-6-Nitro Phenol, 2-AMINO-4-CHLORO-6-NITROPHENOL, SBB003676, CID4348294, TL806305

Molecular Formula:	C₆H₅ClN₂O₃	Molecular Weight:	188.568500 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: MHAFRUMLQZZSIN-UHFFFAOYSA-N

• (1,4'-Bipiperidine)-4'-Carboxamide

IUPAC Name: 4-piperidin-1-ylpiperidine-4-carboxamide | CAS Registry Number: 39633-82-4
Synonyms: NSC76044, CID96486, ZERO/006502, EINECS 254-548-2, NSC 76044, (1,4'-Bipiperidine)-4'-carboxamide, EU-0066587

Molecular Formula:	C₁₁H₂₁N₃O	Molecular Weight:	211.303940 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	3

InChIKey: AUXZEVXPRCVGAO-UHFFFAOYSA-N

• 3-Amino-4-Methoxy Benzoic Acid

IUPAC Name: 3-amino-4-methoxybenzoic acid | CAS Registry Number: 2840-26-8
Synonyms: 3-Amino-p-anisic acid, 3-Amino-4-methoxybenzoic acid, p-Anisic acid, 3-amino-, 3-Amino-4-anisic acid, 186066_ALDRICH, EINECS 220-634-3, BRN 3243089, BENZOIC ACID, 3-AMINO-4-METHOXY-, Kyselina 3-amino-4-methoxybenzoova [Czech], LS-35934, ST5406694, 2-14-00-00360 (Beilstein Handbook Reference), 2840-76-8, InChI=1/C8H9NO3/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4H,9H2,1H3,(H,10,11

Molecular Formula:	C₈H₉NO₃	Molecular Weight:	167.161960 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: FDGAEAYZQQCBRN-UHFFFAOYSA-N

• 1,3,5-Trimethoxybenzene

IUPAC Name: 1,3,5-trimethoxybenzene | CAS Registry Number: 621-23-8
Synonyms: sym-Trimethoxybenzene, Phloroglucinol trimethyl ether, Benzene, 1,3,5-trimethoxy-, 1,3,5-Trimethyoxybenzene, Spectrum_001404, Spectrum2_000426, Spectrum3_001030, Spectrum4_001163, Spectrum5_001766, NCIOpen2_001419, BSPBio_002819, KBioGR_001765, KBioSS_001884, SPECTRUM231043, SPBio_000412, 138827_ALDRICH, O,O,O-1,3,5-Trimethylresorcinol, EINECS 210-673-4, KBio2_001884, KBio2_004452

Molecular Formula:	C₉H₁₂O₃	Molecular Weight:	168.189780 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	3

InChIKey: LKUDPHPHKOZXCD-UHFFFAOYSA-N

• (R)-3-Hydroxybutyric acid ethyl ester

IUPAC Name: ethyl (3R)-3-hydroxybutanoate | CAS Registry Number: 24915-95-5
Synonyms: Ethyl (R)-3-hydroxybutyrate, Ethyl (R)-(-)-3-hydroxybutyrate, Ethyl (R)-3-hydroxybutanoate, ethyl (3R)-3-hydroxybutanoate, (R)-(-)-3-Hydroxybutyric Acid Ethyl Ester, AG-E-74894, PubChem13859, KSC496G9J, ethyl ((r)-3-hydroxybutyrate, 347329_ALDRICH, AC1L98J9, CHEBI:28707, CTK3J6394, MolPort-003-824-843, ACT03203, R-3-Hydroxybutyric acid ethyl ester, ANW-25568, SC1027, SPB-20008, ZINC00388764

Molecular Formula:	C₆H₁₂O₃	Molecular Weight:	132.157680 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: OMSUIQOIVADKIM-RXMQYKEDSA-N

• 4,4' Diiodobiphenyl

IUPAC Name: 1-iodo-4-(4-iodophenyl)benzene | CAS Registry Number: 3001-15-8
Synonyms: 4,4'-Diiodobiphenyl, 4,4'-Diiododiphenyl, 1,1'-Biphenyl, 4,4'-diiodo-, D122408_ALDRICH, 4,4'-Diiodo-1,1'-biphenyl, EINECS 221-080-5, CID76348, 4,4'-DIIODODOPHENYL, PRACT, ST001385, TL8002327

Molecular Formula:	C₁₂H₈I₂	Molecular Weight:	406.000860 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: GPYDMVZCPRONLW-UHFFFAOYSA-N

• 1-Chloronaphthalene

IUPAC Name: 1-chloronaphthalene | CAS Registry Number: 90-13-1
Synonyms: 1-CHLORONAPHTHALENE, xilamon, xylamon, Naphthalene, 1-chloro-, alpha-Chloronaphthalene, 1-Naphthyl chloride, alpha-Chlornaphthalene, .alpha.-Chloronaphthalene, alpha-Naphthyl chloride, 1-Chlornaftalen [Czech], .alpha.-Chlornaphthalene, CCRIS 5546, WLN: L66J BG, HSDB 5269, 442259U_SUPELCO, 185752_ALDRICH, NSC 6166, 25320_FLUKA, EINECS 201-967-3, NSC6166

Molecular Formula:	C₁₀H₇Cl	Molecular Weight:	162.615580 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: JTPNRXUCIXHOKM-UHFFFAOYSA-N

• 2,2'-Anhydro-5-Methyluridine

Synonyms: 2,2'-Anhydro-athy, AIDS231709, AIDS-231709, 2,2'-Anhydro-1-beta-arabinofuranosylthymine, 2,2'-Anhydro-11-beta-D-arabinofuranosylthymine, 6H-Furo(2',3':4,5)oxazolo(3,2-a)pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2-(hydroxymethyl)-7-methyl-, (2R-(2alpha,3beta,3abeta,9abeta))-, 6H-Furo[2',3':4,5]oxazolo[3,2-a]pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2-(hydroxymethyl)-7-methyl-, (2R,3R,3aS,9aR)-

Molecular Formula:	C₁₀H₁₂N₂O₅	Molecular Weight:	240.212680 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	6

InChIKey: WLLOAUCNUMYOQI-JAGXHNFQSA-N

• 2-Chlorobenzophenone

IUPAC Name: (2-chlorophenyl)-phenylmethanone | CAS Registry Number: 5162-03-8
Synonyms: o-Chlorobenzophenone, Benzophenone, 2-chloro-, 2-Chlorobenyl phenyl ketone, Methanone, (2-chlorophenyl)phenyl-, (2-Chlorophenyl)phenylmethanone, NCIOpen2_002858, 194387_ALDRICH, EINECS 225-936-9, NSC 62529, NSC62529, ZINC00155209, AI3-22112, Benzophenone, 2-chloro- (6CI,7CI,8CI), LS-91175, ST5308340, TL8002352, 51330-06-4

Molecular Formula:	C₁₃H₉ClO	Molecular Weight:	216.662960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: VMHYWKBKHMYRNF-UHFFFAOYSA-N

• 4-Anisic Acid

IUPAC Name: 4-methoxybenzoic acid | CAS Registry Number: 100-09-4
Synonyms: p-Anisic acid, Draconic acid, 4-Anisic acid, 4-METHOXYBENZOIC ACID, p-Methoxybenzoic acid, ANISIC ACID, Benzoic acid, 4-methoxy-, 4-Methoxybenzoate, Methoxybenzoic acid, Anisic acid, p-isomer, ANISIC ACID, PARA, 1sv3, P-Methoxy Benzoic Acid, NCIOpen2_004706, W394505_ALDRICH, 117390_ALDRICH, Kyselina 4-methoxybenzoova [Czech], 10550_FLUKA, 84688_FLUKA, CHEBI:40813

Molecular Formula:	C₈H₈O₃	Molecular Weight:	152.147320 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	3

InChIKey: ZEYHEAKUIGZSGI-UHFFFAOYSA-N

• 2-Bromopyridine

IUPAC Name: 2-bromopyridine | CAS Registry Number: 109-04-6
Synonyms: 2-BROMOPYRIDINE, o-Bromopyridine, Pyridine, 2-bromo-, 2-Pyridyl bromide, beta-Bromopyridine, alpha-Bromopyridine, .alpha.-Bromopyridine, .beta.-Bromopyridine, PYRIDINE,2-BROMO, WLN: T6NJ BE, B80100_ALDRICH, NSC 8031, CHEBI:51574, EINECS 203-641-6, NSC8031, AIDS020378, AIDS-020378, BRN 0105789, SBB003999, ZINC00158586

Molecular Formula:	C₅H₄BrN	Molecular Weight:	157.995960 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: IMRWILPUOVGIMU-UHFFFAOYSA-N

• 1-Bromo-3-Chloropropane

IUPAC Name: 1-bromo-3-chloropropane | CAS Registry Number: 109-70-6
Synonyms: 3-Bromopropyl chloride, 3-Chloropropyl bromide, Trimethylene chlorobromide, Propane, 1-bromo-3-chloro-, 1,3-Chlorbromopropane, 1-Chloro-3-bromopropane, 3-Bromo-1-chloropropane, 3-Chloro-1-bromopropane, omega-Chlorobromopropane, 1-BROMO-3-CHLOROPROPANE, .omega.-Chlorobromopropane, l-Chloro-3-bromopropane, 1,3-Chbp, Trimethylene bromide chloride, I-BCP, Trimethylene bromochloride, CCRIS 6536, B62404_ALDRICH, HSDB 5394, B9673_SIGMA

Molecular Formula:	C₃H₆BrCl	Molecular Weight:	157.436740 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: MFESCIUQSIBMSM-UHFFFAOYSA-N

• 3-Chloro-2,2-dimethylpropionyl chloride

IUPAC Name: 3-chloro-2,2-dimethylpropanoyl chloride | CAS Registry Number: 4300-97-4
Synonyms: 3-Chloropivaloyl chloride, beta-Chloropivaloyl chloride, CHLOROPIVALOYL CHLORIDE, 225703_ALDRICH, CID61345, EINECS 224-311-8, NA9263, ZINC01850836, 3-Chloro-2,2-dimethylpropaneyl chloride, 3-chloro-2,2-dimethylpropanoyl chloride, Propanoyl chloride, 3-chloro-2,2-dimethyl-, Chloropivaloyl chloride [NA9263] [Poison]

Molecular Formula:	C₅H₈Cl₂O	Molecular Weight:	155.022420 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: MQZNDDUMJVSIMH-UHFFFAOYSA-N

• (S)-(-)-3-Pyrrolidinol

IUPAC Name: (3S)-pyrrolidin-1-ium-3-ol | CAS Registry Number: 100243-39-8
Synonyms: ZINC01574930, ZINC02140994, CID7003742

Molecular Formula:	C₄H₁₀NO+	Molecular Weight:	88.128300 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	1

InChIKey: JHHZLHWJQPUNKB-BYPYZUCNSA-O

• 2-Chlorobenzonitrile

IUPAC Name: 2-chlorobenzonitrile | CAS Registry Number: 873-32-5
Synonyms: o-Chlorocyanobenzene, o-Cyanochlorobenzene, Benzonitrile, o-chloro-, Benzonitrile, 2-chloro-, Chlorobenzonitrile, o-Chlorbenzonitril, O-CHLOROBENZONITRILE, Benzonitrile, chloro-, o-Chlorbenzonitril [Czech], WLN: NCR BG, MET2015A_SUPELCO, C24795_ALDRICH, Nitril kyseliny o-chlorbenzoove, NSC 8438, 23638_FLUKA, EINECS 212-836-5, NSC8438, Nitril kyseliny o-chlorbenzoove [Czech], ZINC00157274, LS-38653

Molecular Formula:	C₇H₄ClN	Molecular Weight:	137.566360 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: NHWQMJMIYICNBP-UHFFFAOYSA-N

• 1-Boc-4-methyl-4-piperidinecarboxylic Acid

IUPAC Name: 4-methyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid | CAS Registry Number: 189321-63-9
Synonyms: 1-Boc-4-methylpiperidine-4-carboxylic acid, 1-boc-4-methyl-isonipecotic acid, 1-(Tert-Butoxycarbonyl)-4-Methylpiperidine-4-Carboxylic Acid, 4-Methyl-4-carboxy-1-N-Boc-piperidine, 1-Boc-4-Methyl-Piperidine-4-Carboxylic Acid, AG-E-38224, 1-Boc-4-methylpiperidine-4-carboxylicacid, n-boc-4-methyl-4-piperidinecarboxylic acid, n-boc-4-methyl-piperidine-4-carboxylic acid, 1-N-Boc-4-methyl-piperidine-4-carboxylic acid, 4-methyl-piperidine-1,4-dicarboxylic acid mono-tert-butyl ester, PubChem13317, AC1Q1MYX, AC1Q1MYY, SureCN225098, Ambcb4002933, KSC496K4P, Jsp003889, CTK3J6547, MolPort-002-499-890

Molecular Formula:	C₁₂H₂₁NO₄	Molecular Weight:	243.299440 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: OKBNEDPOUYRYNP-UHFFFAOYSA-N

• 2,3-difluorobenzoic acid

IUPAC Name: 2,3-difluorobenzoic acid | CAS Registry Number: 4519-39-5
Synonyms: 2,3-Difluorobenzoic acid, 263516_ALDRICH, JRD-0284, CID370590, SBB006679, TL8003133

Molecular Formula:	C₇H₄F₂O₂	Molecular Weight:	158.102266 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: JLZVIWSFUPLSOR-UHFFFAOYSA-N

• 2-Ethylhexanoyl Chloride

IUPAC Name: 2-ethylhexanoyl chloride | CAS Registry Number: 760-67-8
Synonyms: 2-Ethylhexanoyl chloride, Hexanoyl chloride, 2-ethyl-, 2-Ethylcaproyl chloride, 2-Ethylhexanoic acid, chloride, 2-Ethylhexanoic acid chloride, 157406_ALDRICH, EINECS 212-081-1, NSC 87892, NSC87892, NCGC00164068-01, LS-75506, TL8005199

Molecular Formula:	C₈H₁₅ClO	Molecular Weight:	162.657100 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: WFSGQBNCVASPMW-UHFFFAOYSA-N

• 2-Chlorophenol

IUPAC Name: 2-chlorophenol | CAS Registry Number: 95-57-8
Synonyms: o-Chlorophenol, 2-CHLOROPHENOL, Phenol, 2-chloro-, Phenol, o-chloro-, Chlorophenols, Septi-Kleen, Phenol, chloro-, o-Chlorphenol, o-Chlorophenic acid, 2-Hydroxychlorobenzene, o-monochlorophenol, ortho-chlorophenol, Pine-O Disinfectant, 1wbo, Chlorophenols, solid, CHLOROPHENOL, Chlorophenols, liquid, 2-Chloro-1-hydroxybenzene, Caswell No. 203, p-Chlorfenol [Czech]

Molecular Formula:	C₆H₅ClO	Molecular Weight:	128.556300 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	1

InChIKey: ISPYQTSUDJAMAB-UHFFFAOYSA-N

• 2,4-Dichloro Methyl Benzene

IUPAC Name: 2,4-dichloro-1-methylbenzene | CAS Registry Number: 95-73-8
Synonyms: Toluene, 2,4-dichloro-, 2,4-DICHLOROTOLUENE, 2,4-Dichloro-1-methylbenzene, Benzene, 2,4-dichloro-1-methyl-, 2,4-dichloromethylbenzene, HSDB 2567, 145009_ALDRICH, NSC 8764, EINECS 202-445-8, 2,4-DCT, NSC8764, BRN 1931691, c0865, NCGC00164064-01, LS-154059, ST5406573, 4-05-00-00815 (Beilstein Handbook Reference), InChI=1/C7H6Cl2/c1-5-2-3-6(8)4-7(5)9/h2-4H,1H

Molecular Formula:	C₇H₆Cl₂	Molecular Weight:	161.028540 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	0

InChIKey: FUNUTBJJKQIVSY-UHFFFAOYSA-N

• 4-Methoxy-3-nitroaniline

IUPAC Name: 4-methoxy-3-nitroaniline | CAS Registry Number: 577-72-0
Synonyms: p-Anisidine, 3-nitro-,, Benzenamine, 4-methoxy-3-nitro-, 4-Methoxy-3-nitrobenzenamine, ZINC00336745, CID123071, ST5411960, AO-801/41077431

Molecular Formula:	C₇H₈N₂O₃	Molecular Weight:	168.150020 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	4

InChIKey: RUFOHZDEBFYQSV-UHFFFAOYSA-N

• 5-Methoxyindole-3-carboxylic acid

IUPAC Name: 5-methoxy-1H-indole-3-carboxylic acid | CAS Registry Number: 10242-01-0
Synonyms: NSC88877, CID259191, 5-Methoxy-1H-indole-3-carboxylic acid, SL-00594

Molecular Formula:	C₁₀H₉NO₃	Molecular Weight:	191.183360 [g/mol]
H-Bond Donor:	2	H-Bond Acceptor:	4

InChIKey: RVVSEZGJCOAUED-UHFFFAOYSA-N

• 3-Chloro Phenyl Acetonitrile

IUPAC Name: 2-(3-chlorophenyl)acetonitrile | CAS Registry Number: 1529-41-5
Synonyms: m-Chlorobenzyl cyanide, 3-Chlorobenzyl cyanide, 3-Chlorophenylacetonitrile, 3-Chlorobenzeneacetonitrile, Acetonitrile, (m-chlorophenyl)-, (m-Chlorophenyl)acetonitrile, (3-Chlorophenyl)acetonitrile, C27808_ALDRICH, BENZENEACETONITRILE, 3-CHLORO-, EINECS 216-213-9, BRN 2042965, ZINC00155172, Benzeneacetonitrile, 3-chloro- (9CI), LS-13226, 4-09-00-01675 (Beilstein Handbook Reference), T5297923

Molecular Formula:	C₈H₆ClN	Molecular Weight:	151.592940 [g/mol]
H-Bond Donor:	0	H-Bond Acceptor:	1

InChIKey: GTIKLPYCSAMPNG-UHFFFAOYSA-N

• 5-Nitro-1-(phenymethyl)-1h-Imidazole-4-Carboxylic Acid

IUPAC Name: 1-benzyl-5-nitroimidazole-4-carboxylic acid | CAS Registry Number: 69195-96-6
Synonyms: 1-BENZYL-5-NITRO-1H-IMIDAZOLE-4-CARBOXYLIC ACID, AG-G-69004, 5-Nitro-1-(phenylmethyl)-1H-imidazole-4-carboxylic acid, SureCN3831672, CTK2F2543, MolPort-005-934-076, AKOS015961072, PB10312, AK113572, KB-43856, QC-10688, A836384, 5-nitro-1-(phenylmethyl)-4-imidazolecarboxylic acid, 5-nitro-1-(phenylmethyl)imidazole-4-carboxylic acid, 1-BENZYL-5-NITRO-1H-INMIDAZOLE-4-CARBOXYLIC ACID, 1H-Imidazole-4-carboxylicacid, 5-nitro-1-(phenylmethyl)-, 5-Nitro-1-(phenylmethyl)-1H-imidazole-4-carboxylic acid;

Molecular Formula:	C₁₁H₉N₃O₄	Molecular Weight:	247.206860 [g/mol]
H-Bond Donor:	1	H-Bond Acceptor:	5

InChIKey: AOEZXACMKKLMIY-UHFFFAOYSA-N