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KHBoddin GmbH

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Profile: Karl H. Boddin Chemiehandel GmbH deals with pharmaceutical chemical products, raw materials and intermediates. We provide animal feed additives, foodstuff additives, raw materials for cosmetics and oil-based primary chemical products. Our product line includes acetanilide, acenaphthene, acetoacetanilide, acetylencarboxylic acid, 2-amino-4,5-dimethoxybenzoic acid, ammonium benzoate, benzalkonium chloride, benzotriazole, benzylacetone, benzyl acetate and 2-n-butylbenzofuran.

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• 3-Nitro-O-Cresol
IUPAC Name: 2-methyl-3-nitrophenol | CAS Registry Number: 5460-31-1
Synonyms: 2-Methyl-3-nitrophenol, 3-Nitro-o-cresol, Phenol, 2-methyl-3-nitro-, 2-Hydroxy-6-nitrotoluene, 6-Hydroxy-2-nitrotoluene, 106941_ALDRICH, 3-NITRO-2-METHYL PHENOL, NSC25009, EINECS 226-739-0, SBB008485, ZINC00163570, FR-2158, TL8003577, InChI=1/C7H7NO3/c1-5-6(8(10)11)3-2-4-7(5)9/h2-4,9H,1H

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GAKLFAZBKQGUBO-UHFFFAOYSA-N

• 4-Methyl Diphenyl Sulfide
IUPAC Name: 1-methyl-4-phenylsulfanylbenzene | CAS Registry Number: 3699-01-2
Synonyms: 1-methyl-4-phenylsulfanylbenzene, Benzene, 1-methyl-4-(phenylthio)-, ZINC01095307, CID138011

Molecular Formula: C13H12SMolecular Weight: 200.299380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CPZFPNKPHBCUOB-UHFFFAOYSA-N

• 2-(4-Methoxybenzoyl)thiophene
IUPAC Name: (4-methoxyphenyl)-thiophen-2-ylmethanone | CAS Registry Number: 4160-63-8
Synonyms: 2-(p-Methoxybenzoyl)thiophene, p-Anisyl thiophen-2-yl ketone, 188336_ALDRICH, EINECS 223-997-6, NSC151248, ZINC00119788, (4-methoxyphenyl)(2-thienyl)methanone, methanone, (4-methoxyphenyl)-2-thienyl-, ST5308571, InChI=1/C12H10O2S/c1-14-10-6-4-9(5-7-10)12(13)11-3-2-8-15-11/h2-8H,1H

Molecular Formula: C12H10O2SMolecular Weight: 218.271600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KYVBFEMQEUXVQB-UHFFFAOYSA-N

• 4-Bromoindole-3-carboxaldehyde
IUPAC Name: 4-bromo-1H-indole-3-carbaldehyde | CAS Registry Number: 98600-34-1
Synonyms: 4-Bromo-3-formylindole, ZINC02563719, SBB005308, B2058G1, CID2763178

Molecular Formula: C9H6BrNOMolecular Weight: 224.054040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IPAFHZDRYAWZOB-UHFFFAOYSA-N

• 2-Hydroxyisobutyric Acid
IUPAC Name: 2-hydroxy-2-methylpropanoic acid | CAS Registry Number: 594-61-6
Synonyms: Acetonic acid, 2-Methyllactic acid, 2-HYDROXYISOBUTYRIC ACID, Hydroxydimethylacetic acid, 2-Hydroxy-2-methylpropanoic acid, alpha-Hydroxyisobutyric acid, 2-Hydroxy-2-methylpropionic acid, Lactic acid, 2-methyl-, Lactic acid, 2-methyl-, L-, alpha-Hydroxyisobutanoic acid, Propanoic acid, 2-hydroxy-2-methyl-, .alpha.-Hydroxyisobutyric acid, .alpha.-Hydroxyisobutanoic acid, 164976_ALDRICH, 323594_ALDRICH, CHEBI:50129, NSC4505, Lactic acid, 2-methyl- (8CI), CID11671, NSC 4505

Molecular Formula: C4H8O3Molecular Weight: 104.104520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BWLBGMIXKSTLSX-UHFFFAOYSA-N

• 1,3,Butylene Glycol Dimethacrylate
IUPAC Name: 3-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate | CAS Registry Number: 1189-08-8
Synonyms: 1,3-Butanediol dimethacrylate, 408999_ALDRICH, 1,3-Butylene glycol dimethacrylate, 1,3-Butyleneglycoldimethacrylate, 1-Methyltrimethylene dimethacrylate, EINECS 214-711-0, 2-Propenoic acid, 2-methyl-, 1-methyl-1,3-propanediyl ester, 128424-01-1

Molecular Formula: C12H18O4Molecular Weight: 226.268920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VDYWHVQKENANGY-UHFFFAOYSA-N

• 2-Fluoro-4-Nitrobenzoic acid
IUPAC Name: 2-fluoro-4-nitrobenzoic acid | CAS Registry Number: 403-24-7
Synonyms: NSC190361, CID302679, ST5408285

Molecular Formula: C7H4FNO4Molecular Weight: 185.109363 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: MMWFMFZFCKADEL-UHFFFAOYSA-N

• (2R)-1,2-Epoxy-3-Phenoxypropane
IUPAC Name: (2S)-2-(phenoxymethyl)oxirane | CAS Registry Number: 71031-02-2
Synonyms: (S)-Glycidyl phenyl ether, (2S)-2-(phenoxymethyl)oxirane, (2S)-1,2-Epoxy-3-Phenoxypropane, (S)-2-(Phenoxymethyl)oxirane, 71031-03-3, (S)-1,2-epoxy-3-phenoxypropane, PubChem14082, AC1LTJQ1, 2(S)-phenoxymethyloxirane, (S)-(phenoxymethyl)oxirane, (S)-2-Phenoxymethyl-oxirane, 2alpha-(Phenoxymethyl)oxirane, (2S)-2-Phenoxymethyl-oxirane, (S)-|A-(2-Oxiranyl)anisole, SCHEMBL1583161, CTK8E2647, (S)-2-[(phenoxy)methyl]oxirane, FQYUMYWMJTYZTK-SECBINFHSA-N, (S)-3-phenoxy-1,2-epoxypropane, (2S)-1-phenoxy-2,3-epoxypropane

Molecular Formula: C9H10O2Molecular Weight: 150.177 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: FQYUMYWMJTYZTK-SECBINFHSA-N

• 3-Trifluoromethyl Benzoic Acid
IUPAC Name: 3-(trifluoromethyl)benzoic acid | CAS Registry Number: 454-92-2
Synonyms: 3-(Trifluoromethyl)benzoic acid, 3-Carboxybenzotrifluoride, 3-Trifluoromethylbenzoate, m-CARBOXYBENZOTRIFLUORIDE, 188344_ALDRICH, m-(Trifluoromethyl)benzoic acid, 91770_FLUKA, AIDS018130, alpha,alpha,alpha-Trifluoro-m-toluic acid, AIDS-018130, JRD-0051, NSC43025, 3-TRIFLUOROMETHYLBENZOIC ACID, Benzoic acid, 3-(trifluoromethyl)-, EINECS 207-230-2, NSC 43025, SBB003661, alpha,alpha,alpha-Tri-fluoro-m-toluic acid, Benzoic acid, 3-(trifluoromethyl)- (9CI), TL8003158

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: FQXQBFUUVCDIRK-UHFFFAOYSA-N

• 2-Ethyl Hexylnitrate
IUPAC Name: 2-ethylhexyl nitrate | CAS Registry Number: 27247-96-7
Synonyms: Nitronal, 2-Ethylhexyl nitrate, Ethylhexyl nitrate, 2-Ethylhexylnitrate, 293784_ALDRICH, EINECS 248-363-6, NITRIC ACID, 2-ETHYLHEXYL ESTER, NCGC00164130-01, LS-96721, TL8002198

Molecular Formula: C8H17NO3Molecular Weight: 175.225480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NKRVGWFEFKCZAP-UHFFFAOYSA-N

• 4-Hydroxy-3-methyl acetophenone
IUPAC Name: 1-(4-hydroxy-3-methylphenyl)ethanone | CAS Registry Number: 876-02-8
Synonyms: 4-Hydroxy-3-methylacetophenone, 4'-Hydroxy-3'-methylacetophenone, H38004_ALDRICH, NSC63365, 1-(4-Hydroxy-3-methylphenyl)ethanone, CID70135, EINECS 212-880-5, ZINC00164888, ST5044620, TL8006930, AO-800/41069724, InChI=1/C9H10O2/c1-6-5-8(7(2)10)3-4-9(6)11/h3-5,11H,1-2H

Molecular Formula: C9H10O2Molecular Weight: 150.174500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LXBHHIZIQVZGFN-UHFFFAOYSA-N

• 2-Bromo-5-methylthiophene
IUPAC Name: 2-bromo-5-methylthiophene | CAS Registry Number: 765-58-2
Synonyms: Thiophene, 2-bromo-5-methyl-, 515485_ALDRICH, CID69831, EINECS 212-151-1, ZINC00403354, TL8005238

Molecular Formula: C5H5BrSMolecular Weight: 177.062200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ACDLOOGOFKSUPO-UHFFFAOYSA-N

• 3,3'-Dinitro Diphenyl Disulphide
IUPAC Name: 1-nitro-3-(3-nitrophenyl)disulfanylbenzene | CAS Registry Number: 537-91-7
Synonyms: Hinagen, Megasul, NITROPHENIDE, Megasul (VAN), Bis(3-nitrophenyl) disulfide, Disulfide, bis(3-nitrophenyl), Bis(m-nitrophenyl) disulfide, 3-Nitrophenyl disulfide, m,m'-Dinitrodiphenyl disulfide, Disulfide, bis(m-nitrophenyl), 3,3'-Dinitrodiphenyl disulfide, N21006_ALDRICH, Bis(3-nitrophenyl) disulphide, NSC42172, NSC66160, 3,3'-Dinitro diphenyl disulfide, NSC655043, AIDS155387, AIDS159903, AIDS-155387

Molecular Formula: C12H8N2O4S2Molecular Weight: 308.332920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ODOFDWDUSSFUMN-UHFFFAOYSA-N

• 1-Bromo-4-iodobenzene
IUPAC Name: 1-bromo-4-iodobenzene | CAS Registry Number: 589-87-7
Synonyms: p-Bromoiodobenzene, p-Iodobromobenzene, p-Bromophenyl iodide, Benzene, 1-bromo-4-iodo-, 4-BROMOIODOBENZENE, 238090_ALDRICH, NSC8033, NSC 8033, EINECS 209-662-7, BBV-080402, AI3-09032, InChI=1/C6H4BrI/c7-5-1-3-6(8)4-2-5/h1-4

Molecular Formula: C6H4BrIMolecular Weight: 282.904430 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: UCCUXODGPMAHRL-UHFFFAOYSA-N

• 4-Bromoindole
IUPAC Name: 4-bromo-1H-indole | CAS Registry Number: 52488-36-5
Synonyms: 524336_ALDRICH, ZINC00039644, CID676494, B2073G1, ST5331239, TL8001555, B-8400, B-8404

Molecular Formula: C8H6BrNMolecular Weight: 196.043940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GRJZJFUBQYULKL-UHFFFAOYSA-N

• 4,6-Dihydroxy Pyrimidine
IUPAC Name: 4-hydroxy-1H-pyrimidin-6-one | CAS Registry Number: 1193-24-4
Synonyms: 4,6-Pyrimidinediol, 4,6-DIHYDROXYPYRIMIDINE, pyrimidine-4,6-diol, 6-Hydroxy-4(1H)-pyrimidinone, 4(1H)-Pyrimidinone, 6-hydroxy-, 4(3H)-Pyrimidinone, 6-hydroxy-, 6-Hydroxy-1H-pyrimidin-4-one, MLS000774924, D120405_ALDRICH, 4,6-Dihydroxypyrimidin [German], EINECS 214-772-3, NSC 22838, AIDS049431, AIDS-049431, NSC22838, LS-624, ZINC03860379, SMR000368133, ST5431220, TL8000516

Molecular Formula: C4H4N2O2Molecular Weight: 112.086760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DUFGYCAXVIUXIP-UHFFFAOYSA-N

• 4-Methoxy Thioanisole
IUPAC Name: 1-methoxy-4-methylsulfanylbenzene | CAS Registry Number: 1879-16-9
Synonyms: p-(Methylthio)anisole, 4-(Methylthio)anisole, 4-Methoxythioanisole, MMTB, p-Anisyl methyl sulfide, Anisole, p-(methylthio)-, P-METHOXYTHIOANISOLE, Methyl p-methoxyphenyl sulfide, p-Methoxyphenyl methyl sulfide, 1-Methoxy-4-methylthiobenzene, Methyl 4-methoxyphenyl sulfide, 1-Methoxy-4-(methylthio)benzene, 258709_ALDRICH, Benzene, 1-methoxy-4-(methylthio)-, 1-methoxy-4-methylsulfanylbenzene, Anisole, p-(methylthio)- (8CI), NSC124839, ZINC00409171, NSC 124839, Benzene, 1-methoxy-4-(methylthio)- (9CI)

Molecular Formula: C8H10OSMolecular Weight: 154.229400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: DQNSKXYRRRCKGH-UHFFFAOYSA-N

• 4-Nitroacetophenone
IUPAC Name: 1-(4-nitrophenyl)ethanone | CAS Registry Number: 100-19-6
Synonyms: p-Nitroacetophenone, 4'-Nitroacetophenone, p-Acetylnitrobenzene, Paranitroacetophenone, Acetophenone, 4'-nitro-, PNAP, 4-NITROACETOPHENONE, p-Nitrophenyl methyl ketone, Ethanone, 1-(4-nitrophenyl)-, Methyl-p-nitrophenyl ketone, 1-(4-Nitrophenyl)ethanone, CCRIS 1676, N9608_ALDRICH, MLS002152933, EINECS 202-827-4, CID7487, NSC 41590, NSC41590, LS-296, ZINC00164801

Molecular Formula: C8H7NO3Molecular Weight: 165.146080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YQYGPGKTNQNXMH-UHFFFAOYSA-N

• 3-Nitro-4-chloro phenyl methyl sulfone
IUPAC Name: 1-chloro-4-methylsulfonyl-2-nitrobenzene | CAS Registry Number: 97-07-4
Synonyms: 3-Nitro-4-chlorophenyl methyl sulfone, 4-Chloro-3-nitrophenyl methyl sulfone, NSC25818, EINECS 202-557-7, NSC 25818, ZINC01509333, Sulfone, 4-chloro-3-nitrophenyl methyl, 4-CHLORO-3-NITROPHENYLMETHYLSULFONE, Benzene, 1-chloro-4-(methylsulfonyl)-2-nitro-, ST5409549, 1-Chloro-4-(methylsulphonyl)-2-nitrobenzene, Sulfone, 4-chloro-3-nitrophenyl methyl (8CI)

Molecular Formula: C7H6ClNO4SMolecular Weight: 235.644840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: JAANTSGNTKWLFA-UHFFFAOYSA-N

• (S)-1-Benzyloxy-2-propanol
IUPAC Name: (2S)-1-phenylmethoxypropan-2-ol | CAS Registry Number: 85483-97-2
Synonyms: (S)-(+)-1-Benzyloxy-2-propanol, (S)-1-O-Benzylpropylene glycol, (S)-1-(benzyloxy)propan-2-ol, SureCN2181772, 650838_ALDRICH, CTK5F5107, MolPort-003-938-276, ZINC00394064, LS30228, 2-Propanol,1-(phenylmethoxy)-, (2S)-, AK116197, KB-210697, I01-7432

Molecular Formula: C10H14O2Molecular Weight: 166.216960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: KJBPYIUAQLPHJG-VIFPVBQESA-N

• 3-Hydroxy Thiophenol
IUPAC Name: 3-sulfanylphenol | CAS Registry Number: 40248-84-8
Synonyms: 3-Hydroxythiophenol, 3-sulfanylphenol, 3-Mercaptophenol, 3-Hydroxybenzenethiol, 3-Hydroxy thiophenol, 3-Sulphanylphenol, PubChem6829, Phenol, 3-mercapto-, ACMC-209jca, AC1MC5YX, SureCN21502, KSC235M9N, 568899_ALDRICH, Jsp006961, CTK1D5696, DOFIAZGYBIBEGI-UHFFFAOYSA-, MolPort-001-757-023, ANW-29336, OR0777, AKOS007930181

Molecular Formula: C6H6OSMolecular Weight: 126.176240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: DOFIAZGYBIBEGI-UHFFFAOYSA-N

• 4-Bromofluorobenzene
IUPAC Name: 1-bromo-4-fluorobenzene | CAS Registry Number: 460-00-4
Synonyms: p-Bromofluorobenzene, p-Fluorobromobenzene, 1-Bromo-4-fluorobenzene, 4-Fluorobromobenzene, p-Fluorophenyl bromide, 4-Fluorophenyl bromide, Benzene, 1-bromo-4-fluoro-, 1-Fluoro-4-bromobenzene, 4-Fluoro-1-bromobenzene, B67201_ALDRICH, 442404_SUPELCO, 1-BROMO-4-FLOUROBENZENE, 17080_FLUKA, EINECS 207-300-2, NSC9460, NSC 10268, NSC10268, NCGC00164249-01, B113, LS-29201

Molecular Formula: C6H4BrFMolecular Weight: 174.998363 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AITNMTXHTIIIBB-UHFFFAOYSA-N

• 4-Benzyloxyindole
IUPAC Name: 4-(phenylmethoxy)-1H-indole | CAS Registry Number: 20289-26-3
Synonyms: 4-benzoxy-1H-indole, 4-(Phenylmethoxy)-1H-indole, 246212_ALDRICH, 1H-Indole, 4-(phenylmethoxy)-, NSC92539, EINECS 243-690-0, ZINC00407088, B2099G1, ST5307438, B-1600

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LJFVSIDBFJPKLD-UHFFFAOYSA-N

• 4-Chloro-7-azaindole
IUPAC Name: 4-chloro-1H-pyrrolo[2,3-b]pyridine | CAS Registry Number: 55052-28-3
Synonyms: 4-CHLORO-7-AZAINDOLE, 4-chloro-1H-pyrrolo[2,3-b]pyridine, AG-F-92201, 1H-PYRROLO[2,3-B]PYRIDINE, 4-CHLORO-, AN-584/43416898, PubChem17277, AC1Q3HXF, AC1Q3HXG, ACMC-1AY8O, SureCN100651, 4-CHLORO-7-AZAINDOL, KSC494A8L, AGN-PC-0084ST, 4-chloropyrrolo[2,3-b]pyridine, CTK3J4085, HIN1337, MolPort-001-758-292, ACN-S002668, ACT03614, 4-chlor-1H-pyrrolo[2,3-b]pyridin

Molecular Formula: C7H5ClN2Molecular Weight: 152.581000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HNTZVGMWXCFCTA-UHFFFAOYSA-N

• 3-Trifluoromethyl thiophenol
IUPAC Name: 3-(trifluoromethyl)benzenethiol | CAS Registry Number: 937-00-8
Synonyms: m-Trifluoromethylthiophenol, 3-Trifluoromethylthiophenol, NCIOpen2_001443, 3-(Trifluoromethyl)thiophenol, NSC88281, ST5411464, TL8006777

Molecular Formula: C7H5F3SMolecular Weight: 178.174810 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SCURCOWZQJIUGR-UHFFFAOYSA-N

• 2'-Hydroxyacetophenone
IUPAC Name: 1-(2-hydroxyphenyl)ethanone | CAS Registry Number: 118-93-4
Synonyms: 2-Acetylphenol, o-Acetylphenol, Acetophenone, 2'-hydroxy-, O-HYDROXYACETOPHENONE, Acetophenone, o-hydroxy-, 1-(2-Hydroxyphenyl)ethanone, Ethanone, 1-(2-hydroxyphenyl)-, USAF KE-20, o-Hydroxyphenyl methyl ketone, 2-Hydroxyphenyl methyl ketone, Methyl 2-hydroxyphenyl ketone, FEMA No. 3548, WLN: QR BV1, H18607_ALDRICH, ACETOPHENONE,2-HYDROXY, W354805_ALDRICH, 54150_FLUKA, EINECS 204-288-0, NSC9263, NSC 16933

Molecular Formula: C8H8O2Molecular Weight: 136.147920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JECYUBVRTQDVAT-UHFFFAOYSA-N

• 3-fluoro thiophenol
IUPAC Name: 3-fluorobenzenethiol | CAS Registry Number: 2557-77-9
Synonyms: m-Fluorothiophenol, 3-Fluorothiophenol, m-Fluorobenzenethiol, 3-Fluoro thiophenol, 3-Fluorobenzenethiol, Benzenethiol, 3-fluoro-, 275387_ALDRICH, CID75710, EINECS 219-876-2, TL806409, TL8006731, Y11010

Molecular Formula: C6H5FSMolecular Weight: 128.167303 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ZDEUGINAVLMAET-UHFFFAOYSA-N

• 4-Fluorophenylhydrazine hydrochloride
IUPAC Name: (4-fluorophenyl)hydrazine hydrochloride | CAS Registry Number: 823-85-8
Synonyms: F14203_ALDRICH, p-FLUOROPHENYLHYDRAZINE HCL, EINECS 212-521-2, EINECS 254-990-6, BTB 08671, (4-Fluorophenyl)hydrazine hydrochloride, (4-Fluorophenyl)hydrazine monohydrochloride, TL8005449, 40594-35-2

Molecular Formula: C6H8ClFN2Molecular Weight: 162.592523 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: FEKUXLUOKFSMRO-UHFFFAOYSA-N

• 3-Hydroxybenzaldehyde
IUPAC Name: 3-hydroxybenzaldehyde | CAS Registry Number: 100-83-4
Synonyms: m-Formylphenol, 3-hydroxybenzaldehyde, 3-Formylphenol, m-Hydroxybenzaldehyde, Benzaldehyde, 3-hydroxy-, meta-Hydroxybenzaldehyde, Benzaldehyde, m-hydroxy-, 3-OH-BENZALDEHYDE, H19808_ALDRICH, 3-HYDROXY-BENZALDEHYDE, NSC 3504, CHEBI:16207, EINECS 202-892-9, NSC3504, BRN 0507099, c0055, ZINC00901630, AI3-12120, LS-25059, ST5213351

Molecular Formula: C7H6O2Molecular Weight: 122.121340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IAVREABSGIHHMO-UHFFFAOYSA-N

• 4,4-Dimethyl-3-oxopentanenitrile
IUPAC Name: 4,4-dimethyl-3-oxopentanenitrile | CAS Registry Number: 59997-51-2
Synonyms: Pivaloylacetonitrile, 4,4-Dimethyl-3-oxovaleronitrile, 262382_ALDRICH, EINECS 262-017-1, Valeronitrile, 4,4-dimethyl-3-oxo-, Pentanenitrile, 4,4-dimethyl-3-oxo-, SBB008437, ZINC00159361, FR-2053, TL806194, LS-101738, InChI=1/C7H11NO/c1-7(2,3)6(9)4-5-8/h4H2,1-3H

Molecular Formula: C7H11NOMolecular Weight: 125.168340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MXZMACXOMZKYHJ-UHFFFAOYSA-N

• 11-Piperazynil-Dibenzo[b,f][1,4]Thiazepine dihydrochloride
IUPAC Name: 6-piperazin-1-ylbenzo[b][1,4]benzothiazepine;dihydrochloride | CAS Registry Number: 111974-74-4
Synonyms: 11-(1-Piperazinyl)-dibenzo[b,f][1,4]thiazepine dihydrochloride, 11-Piperazynil-Dibenzo[b,f][1,4]Thiazepine 2HCL, 11-piperazin-1-yl-dibenzo[b,f][1,4]thiazepine 2hcl, 11-Piperazinodibenzo[b,f][1,4]thiazepine dihydrochloride, 11-piperazinodibenzo(b,f)(1,4)thiazepine dihydrochloride, 11-(1-piperazinyl)-dibenzo(b,f)(1,4)thiazepine dihydrochloride, ACMC-209tvy, SureCN8507, KSC497C0T, CTK3J7109, MolPort-003-986-237, ACN-S002262, ANW-43004, AKOS015895322, AC-1919, AK-26935, I862, KB-10985, TL8000349, AM20020202

Molecular Formula: C17H19Cl2N3SMolecular Weight: 368.323860 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: PZQCQHZDUIIKFU-UHFFFAOYSA-N

• 4-Chloropyridine Hydrochloride
IUPAC Name: 4-chloropyridine hydrochloride | CAS Registry Number: 7379-35-3
Synonyms: 4-CHLOROPYRIDINE, 4-Chloropyridine hydrochloride, 4-CHLOROPYRIDINE HCl, CCRIS 1716, C70223_ALDRICH, Pyridine, 4-chloro-, hydrochloride, 26300_FLUKA, EINECS 230-946-1, NSC 78418, NSC78418, C119, SL-00427, LS-188403

Molecular Formula: C5H5Cl2NMolecular Weight: 150.005900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: XGAFCCUNHIMIRV-UHFFFAOYSA-N

• 4-Methoxyphenyl Methyl Sulfone
IUPAC Name: 1-methoxy-4-methylsulfonylbenzene | CAS Registry Number: 3517-90-6
Synonyms: p-Anisyl methyl sulfone, Anisole, p-(methylsulfonyl)-, p-(Methylsulfonyl)anisole, p-Methoxyphenyl methyl sulfone, 4-Methoxyphenyl methyl sulfone, Methyl 4-methoxyphenyl sulfone, Benzene, 1-methoxy-4-(methylsulfonyl)-, 1-methoxy-4-methylsulfonylbenzene, 4-METHOXYPHENYLMETHYLSULFONE, NSC87355, ZINC00394759, ST5036111, TL8006884, InChI=1/C8H10O3S/c1-11-7-3-5-8(6-4-7)12(2,9)10/h3-6H,1-2H

Molecular Formula: C8H10O3SMolecular Weight: 186.228200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KAZUCVUGWMQGMC-UHFFFAOYSA-N

• 5-Hydroxy Indole
IUPAC Name: 1H-indol-5-ol | CAS Registry Number: 1953-54-4
Synonyms: 5-Hydroxyindole, 1H-Indol-5-ol, INDOL-5-OL, 5-Hydroxy-1H-indole, Hydroxy-5 indole, 5-Indolol, Hydroxy-5 indole [French], CCRIS 4422, NCIOpen2_001272, WLN: T56 BMJ GQ, 1H-Indol-5-ol (9CI), H31859_ALDRICH, Hydroxy-5 indole [French], MLS000039632, 5-HI, EINECS 217-782-6, NSC 87503, NSC87503, BRN 0112349, NSC-87503

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LMIQERWZRIFWNZ-UHFFFAOYSA-N

• 3-Nitro thioanisole
IUPAC Name: 1-methylsulfanyl-3-nitrobenzene | CAS Registry Number: 2524-76-7
Synonyms: 1-(Methylthio)-3-nitrobenzene, NSC53644, CID75656, EINECS 219-761-7, ST5410222

Molecular Formula: C7H7NO2SMolecular Weight: 169.200980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: GBGVXOUUXAIELM-UHFFFAOYSA-N

• 4-Nitro-N,N-Di(4-Methoxyphenyl) Benzenamine
IUPAC Name: N,N-bis(4-methoxyphenyl)-4-nitroaniline | CAS Registry Number: 20440-91-9
Synonyms: 4-Methoxy-N-(4-methoxyphenyl)-N-(4-nitrophenyl)aniline, CTK4E4227, ACN-S002629, ANW-53868, ZINC55168593, AKOS015915362, AG-E-49883, 4,4'-Dimethoxy-4''-nitrotriphenylamine, AK-88029, BD232222, N,N-bis(4-methoxyphenyl)-4-nitroaniline, N,N-bis(4-methoxyphenyl)-4-nitro-aniline, 4-nitro-n,n-di(4-methoxyphenyl)benzenamine, KB-193620, 4-nitro-N,N-di(4-methoxyphenyl) benzenamine, ST51055411, Benzenamine,N,N-bis(4-methoxyphenyl)-4-nitro-, A814561, I14-6428, Triphenylamine,4,4'-dimethoxy-4''-nitro- (8CI);4-Nitro-N,N-di(4-methoxyphenyl)benzenamine;4,4'-Dimethoxy-4''-nitrotriphenylamine;

Molecular Formula: C20H18N2O4Molecular Weight: 350.367920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: IRTXFNPBVZYVOU-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: C12H10O4SMolecular Weight: 250.270400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: VPWNQTHUCYMVMZ-UHFFFAOYSA-N

• 4,4'-Biphenyldicarboxylic Acid
IUPAC Name: 4-(4-carboxyphenyl)benzoic acid | CAS Registry Number: 787-70-2
Synonyms: p,p'-Diphenic acid, 4,4'-Diphenic acid, 4,4'-Bibenzoic acid, 4,4'-Dicarboxybiphenyl, BIBENZOIC ACID, USAF DO-69, WLN: QVR DR DVQ, Oprea1_519768, 4,4'-Biphenyl dicarboxylic acid, Biphenyl-4,4'-dicarboxylic acid, 225266_ALDRICH, 4,4'-BIPHENYLDICARBOXYLIC ACID, EINECS 212-328-3, NSC 60016, NSC60016, BRN 0523308, STK012281, (1,1'-Biphenyl)-4,4'-dicarboxylic acid, LS-44301, [1,1'-Biphenyl]-4,4'-dicarboxylic acid

Molecular Formula: C14H10O4Molecular Weight: 242.226800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: NEQFBGHQPUXOFH-UHFFFAOYSA-N

• 1,4-Dichlorobutane
IUPAC Name: 1,4-dichlorobutane | CAS Registry Number: 110-56-5
Synonyms: 1,4-DICHLOROBUTANE, Butane, 1,4-dichloro-, Tetramethylene dichloride, D59100_ALDRICH, NSC6288, 235652_ALDRICH, 442248_SUPELCO, NSC 6288, EINECS 203-778-1, CID8059, LS-184868, InChI=1/C4H8Cl2/c5-3-1-2-4-6/h1-4H

Molecular Formula: C4H8Cl2Molecular Weight: 127.012320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KJDRSWPQXHESDQ-UHFFFAOYSA-N

• 5-Bromothiophene-2-carboxaldehyde
IUPAC Name: 5-bromothiophene-2-carbaldehyde | CAS Registry Number: 4701-17-1
Synonyms: 5-Bromothenaldehyde, 5-Bromo-2-thiophenecarboxaldehyde, 152625_ALDRICH, 5-Bromo-2-thiophenecarbaldehyde, 5-Bromothiophene-2-carbaldehyde, 2-Bromo-5-thiophenecarboxaldehyde, ZINC00032313, CID78428, EINECS 225-176-8, 2-Thiophenecarboxaldehyde, 5-bromo-, SBB000294, TL8006906

Molecular Formula: C5H3BrOSMolecular Weight: 191.045720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: GFBVUFQNHLUCPX-UHFFFAOYSA-N

• 4-Methylthio phenyl acetic acid
IUPAC Name: 2-(4-methylsulfanylphenyl)acetic acid | CAS Registry Number: 16188-55-9
Synonyms: 4-(Methylthio)phenylacetic acid, 2-(4-(methylthio)phenyl)acetic acid, 4-Methylthiophenylaceticacid, F2182-0137, 2-(4-methylthiophenyl)acetic acid, 2-(4-methylsulfanylphenyl)acetic Acid, AC1NLKSL, PubChem10785, SureCN46640, AC1Q4GZ9, 396591_ALDRICH, CTK3I9799, GEO-01963, SBB068771, (4-Methylsulfanyl-phenyl)-acetic acid, AKOS000279298, AG-E-11620, MCULE-6921616947, RP24342, AK-45539

Molecular Formula: C9H10O2SMolecular Weight: 182.239500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AHMLFHMRRBJCRM-UHFFFAOYSA-N

• 2-Methyl-3-Nitrobenzoic Acid
IUPAC Name: 2-methyl-3-nitrobenzoic acid | CAS Registry Number: 1975-50-4
Synonyms: 3-Nitro-o-toluic acid, 2-METHYL-3-NITROBENZOIC ACID, Benzoic acid, 2-methyl-3-nitro-, Oprea1_641068, 137847_ALDRICH, 3-Nitro-2-methyl benzoic acid, TPC-B005, TPC-I003, EINECS 217-826-4, CID16096, LS-976, NCGC00091604-01, ST5406632, M-4208, InChI=1/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11

Molecular Formula: C8H7NO4Molecular Weight: 181.145480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YPQAFWHSMWWPLX-UHFFFAOYSA-N

• 2-Amino-3,5-dibromo pyrid
IUPAC Name: 3,5-dibromopyridin-2-amine | CAS Registry Number: 35486-42-1
Synonyms: 2-Amino-3,5-dibromopyridine, Maybridge1_001693, 3,5-dibromo-2-pyridinylamine, 3,5-Dibromo-2-pyridylamine, MLS000702186, 180505_ALDRICH, 2-Pyridinamine, 3,5-dibromo-, AIDS020446, AIDS-020446, EINECS 252-590-6, NSC170846, SBB000910, A149, SMR000224601, TL8002635, AC-907/30003001

Molecular Formula: C5H4Br2N2Molecular Weight: 251.906660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: WJMJWMSWJSACSN-UHFFFAOYSA-N

• 5-Bromo Azaindole
IUPAC Name: 5-bromo-1H-pyrrolo[2,3-b]pyridine | CAS Registry Number: 183208-35-7
Synonyms: 5-Bromo-7-azaindole, 5-bromo-1H-pyrrolo[2,3-b]pyridine, RW2897, SBB054655, 3-Bromo-7H-pyrrolo[2,3-b]pyridine, 5-bromo-1H-pyrrolo[2 , 3-b]pyridine, 5-bromopyrrolo[2,3-b]pyridine, PubChem14698, 5-BROMO AZAINDOLE, ACMC-1C0UF, SureCN153413, SureCN755641, KSC174K5D, AC1Q258Q, Jsp003754, CTK0H4551, HIN1529, MolPort-001-794-121, ACN-S002666, ACN-S003136

Molecular Formula: C7H5BrN2Molecular Weight: 197.032000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LPTVWZSQAIDCEB-UHFFFAOYSA-N

• 4-Benyloxybenzaldehyde
IUPAC Name: 4-(phenylmethoxy)benzaldehyde | CAS Registry Number: 4397-53-9
Synonyms: 4-(Benzyloxy)benzaldehyde, p-(Benzyloxy)benzaldehyde, 4-Benzyloxybenzaldehyde, Benzaldehyde, p-(benzyloxy)-, Benzaldehyde, 4-(phenylmethoxy)-, CBMicro_014912, 4-phenylmethoxy-benzaldehyde, 123714_ALDRICH, 13619_FLUKA, NSC28298, EINECS 224-527-2, NSC 28298, NSC131669, SBB000526, ZINC00119353, Benzaldehyde, p-(benzyloxy)- (8CI), NSC 131669, BIM-0014979.P001, 5570-82-1

Molecular Formula: C14H12O2Molecular Weight: 212.243880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZVTWZSXLLMNMQC-UHFFFAOYSA-N

• 2-Nitrothiophene
IUPAC Name: 2-nitrothiophene | CAS Registry Number: 609-40-5
Synonyms: 2-NITROTHIOPHENE, Thiophene, 2-nitro-, WLN: T5SJ BNW, N27004_ALDRICH, NSC 5371, EINECS 210-190-9, NSC5371, AIDS018968, AIDS-018968, ZINC01680876, AI3-16618, LS-153141, ST5214486, TL8003858, InChI=1/C4H3NO2S/c6-5(7)4-2-1-3-8-4/h1-3

Molecular Formula: C4H3NO2SMolecular Weight: 129.137120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JIZRGGUCOQKGQD-UHFFFAOYSA-N

• 4-Chloro-2-Nitrotoluene
IUPAC Name: 4-chloro-1-methyl-2-nitrobenzene | CAS Registry Number: 89-59-8
Synonyms: 4,2-Chloronitrotoluene, 4-CHLORO-2-NITROTOLUENE, p-Chloro-o-nitrotoluene, 2-Nitro-4-chlorotoluene, Toluene, 4-chloro-2-nitro-, 101702_ALDRICH, 45998_RIEDEL, CCRIS 3116, NSC5386, Benzene, 4-chloro-1-methyl-2-nitro-, NSC 5386, EINECS 201-921-2, ZINC01680885, Toluene, 4-chloro-2-nitro- (8CI), Benzene, 4-chloro-1-methyl-3-nitro-, AI3-00494, ST5405400, TL80073507, C-5230, InChI=1/C7H6ClNO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SQFLFRQWPBEDHM-UHFFFAOYSA-N

• 4-Nitrobenzoyl Chloride
IUPAC Name: 4-nitrobenzoyl chloride | CAS Registry Number: 122-04-3
Synonyms: 4-Nitrobenzoyl chloride, P-NITROBENZOYL CHLORIDE, Benzoyl chloride, 4-nitro-, Benzoyl chloride, p-nitro-, nchembio.87-comp28, p-Nitrobenzoic acid chloride, 4-Nitro-benzoyl chloride, 4-Nitrobenzoic acid chloride, Nitrobenzoyl chloride, 4-, PHENYLACETYL CHLORIDE, CCRIS 3136, 112208_ALDRICH, NSC 5381, 73120_FLUKA, 73122_FLUKA, EINECS 204-517-4, NSC5381, BRN 0473192, LS-661, ZINC01680883

Molecular Formula: C7H4ClNO3Molecular Weight: 185.564560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SKDHHIUENRGTHK-UHFFFAOYSA-N

• 4-Trifluoromethyl thiophenol
IUPAC Name: 4-(trifluoromethyl)benzenethiol | CAS Registry Number: 825-83-2
Synonyms: 4-(Trifluoromethyl)thiophenol, TL 00292, TL8006773

Molecular Formula: C7H5F3SMolecular Weight: 178.174810 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WCMLRSZJUIKVCW-UHFFFAOYSA-N

• 6-Amino-1,3-DimethylUracil
IUPAC Name: 6-amino-1,3-dimethylpyrimidine-2,4-dione | CAS Registry Number: 6642-31-5
Synonyms: 6-Amino-1,3-dimethyluracil, 1,3-Dimethyl-6-amino-uracil, Uracil, 6-amino-1,3-dimethyl-, Oprea1_258982, A52153_ALDRICH, EINECS 229-662-0, NSC 15492, NSC15492, BRN 0144390, SBB004028, ZINC00105224, AI3-52449, LS-158544, 2,4(1H,3H)-Pyrimidinedione, 6-amino-1,3-dimethyl-, 4-Amino-1,3-dimethyl-2,6-dihydroxypyrimidine, 6-Amino-1,3-dimethyl-2,4(1H,3H)-pyrimidinedione, 5-25-15-00389 (Beilstein Handbook Reference), AB-323/25048015, 6-amino-1,3-dimethylpyrimidine-2,4(1H,3H)-dione

Molecular Formula: C6H9N3O2Molecular Weight: 155.154560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VFGRNTYELNYSKJ-UHFFFAOYSA-N


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