CAS: 74457-86-6 Molecular Formula: C9H9FO2 Molecular Weight (g/mol): 168.17 MDL Number: MFCD00042290 InChI Key: PIRRWUMTIBFCCW-UHFFFAOYSA-N Synonym: zlchem 344, ethanone, 1-2-fluoro-4-methoxyphenyl, 2-fluoro-4-methoxy-acetophenone, 2'-fluor-4'-methoxyacetophenone, 1-acetyl-2-fluoro-4-methoxybenzene, 4-acetyl-3-fluoroanisole, 1-2-fluoro-4-methoxyphenyl ethan-1-one, 1-2-fluoro-4-methoxyphenyl ethanone, 2-fluoro-4-methoxyacetophenone, 2'-fluoro-4'-methoxyacetophenone PubChem CID: 592821 IUPAC Name: 1-(2-fluoro-4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C(C)=O)C(F)=C1

CAS: 40188-45-2 Molecular Formula: C12H15NO3 Molecular Weight (g/mol): 221.26 MDL Number: MFCD00798556 InChI Key: FGWZEOPEZISTTR-UHFFFAOYSA-N Synonym: n-3-acetyl-4-hydroxyphenyl butanamid, acebutolol impurity c, 5'-butyramido-2'-hydroxyacetophenone, butanamide, n-3-acetyl-4-hydroxyphenyl, 3'-acetyl-4'-hydroxybutyranilide, unii-14qjb65r4v, ac-hophe-oh, n-3-acetyl-4-hydroxyphenyl butyramide, n-3-acetyl-4-hydroxyphenyl butanamide, 2-acetyl-4-butyramidophenol PubChem CID: 736331 IUPAC Name: N-(3-acetyl-4-hydroxyphenyl)butanamide SMILES: CCCC(=O)NC1=CC=C(O)C(=C1)C(C)=O

CAS: 121-71-1 Molecular Formula: C₈H₈O₂ Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3-acetophenol, 3-hydroxy acetophenone, m-acetylphenol, ethanone, 1-3-hydroxyphenyl, 1-3-hydroxyphenyl ethan-1-one, 3-acetylphenol, m-hydroxyacetophenone, 1-3-hydroxyphenyl ethanone, 3-hydroxyacetophenone, 3'-hydroxyacetophenone PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O

CAS: 42472-69-5 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.17 MDL Number: MFCD04974025 InChI Key: WHFPFLKZXFBCSO-UHFFFAOYSA-N Synonym: ethanone,1-4-ethynylphenyl, 1-4-ethynylphenyl-ethanone, 4-acetylphenyl acetylene, 4-acetylphenylethyne, 1-4-ethynylphenyl ethan-1-one, 4'-ethynylacetophenone, ethanone, 1-4-ethynylphenyl, 4-acetylphenylacetylene, 1-4-ethynyl-phenyl-ethanone, 1-4-ethynylphenyl ethanone PubChem CID: 5123626 IUPAC Name: 1-(4-ethynylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C#C

CAS: 5398-11-8 MDL Number: MFCD00023099

CAS: 149105-11-3 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD01091005 InChI Key: HKRUXZJKSFFSGF-UHFFFAOYSA-N Synonym: 5-acetyl-2-hydroxybenzotrifluoride, intermediates-zcf02143, acmc-1bxyq, ethanone,1-4-hydroxy-3-trifluoromethyl phenyl, 1-4-hydroxy-3-trifluoromethylphenyl ethanone, 1-4-hydroxy-3-trifluoromethyl phenyl ethan-1-one, 4'-hydroxy-3'-trifluoromethyl acetophenone, 1-4-hydroxy-3-trifluoromethyl phenyl ethanone, 4-hydroxy-3-trifluoromethyl acetophenone PubChem CID: 2775109 IUPAC Name: 1-[4-hydroxy-3-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=CC(=C(C=C1)O)C(F)(F)F

CAS: 13670-99-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.13 MDL Number: MFCD00000328 InChI Key: VGIIILXIQLXVLC-UHFFFAOYSA-N Synonym: intermediates-zcf02054, pubchem4218, fr cf bv1, 1-acetyl-2,6-difluorobenzene, acetophenone, 2',6'-difluoro, ethanone, 1-2,6-difluorophenyl, 1-2,6-difluorophenyl ethan-1-one, 2,6-difluoroacetophenone, 1-2,6-difluorophenyl ethanone, 2',6'-difluoroacetophenone PubChem CID: 83643 SMILES: CC(=O)C1=C(F)C=CC=C1F

CAS: 518-82-1 Molecular Formula: C₁₅H₁₀O₅ Molecular Weight (g/mol): 270.23 MDL Number: MFCD00001207 InChI Key: RHMXXJGYXNZAPX-UHFFFAOYSA-N Synonym: 1,3,8-trihydroxy-6-methyl-9,10-anthraquinone, persian berry lake, archin, 3-methyl-1,6,8-trihydroxyanthraquinone, frangulic acid, rheum emodin, frangula emodin, emodol, schuttgelb, emodin PubChem CID: 3220 ChEBI: CHEBI:42223 IUPAC Name: 1,3,8-trihydroxy-6-methylanthracene-9,10-dione SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O

CAS: 175135-93-0 Molecular Formula: C10H10BrClO Molecular Weight (g/mol): 261.543 MDL Number: MFCD00067862 InChI Key: RGMFWCVOMGKIJM-UHFFFAOYSA-N Synonym: 2-bromanyl-1-3-chloranyl-4-methyl-phenyl propan-1-one, 2-bromo-1-3-chloro-4-methylphenyl-1-propanone, 2-bromo-3'-chloro-4'methyl propiophenone, 1-propanone,2-bromo-1-3-chloro-4-methylphenyl, 2-bromo-3'-chloro-4'-methylpropiophenone, 2-bromo-1-3-chloro-4-methylphenyl propan-1-one PubChem CID: 2774950 IUPAC Name: 2-bromo-1-(3-chloro-4-methylphenyl)propan-1-one SMILES: CC1=C(C=C(C=C1)C(=O)C(C)Br)Cl

CAS: 88-15-3 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005442 InChI Key: WYJOVVXUZNRJQY-UHFFFAOYSA-N Synonym: 2-thienyl methyl ketone, ketone, methyl 2-thienyl, 2-acetyl thiophene, ethanone, 1-2-thienyl, 2-acetothiophene, 2-acetothienone, methyl 2-thienyl ketone, 1-thiophen-2-yl-ethanone, 1-2-thienyl ethanone, 2-acetylthiophene PubChem CID: 6920 IUPAC Name: 1-thiophen-2-ylethanone SMILES: CC(=O)C1=CC=CS1

CAS: 6781-42-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008740 InChI Key: VCHOFVSNWYPAEF-UHFFFAOYSA-N Synonym: m-diacetyl benzene, 1-3-acetylphenyl ethan-1-one, 1-3-acetylphenyl ethanone, m-acetyl acetophenone, m-acetylacetophenone, benzene-1,3-bis acetyl, m-diacetylbenzene, ethanone, 1,1'-1,3-phenylene bis, 1,1'-1,3-phenylene diethanone, 1,3-diacetylbenzene PubChem CID: 23229 SMILES: CC(=O)C1=CC(=CC=C1)C(C)=O

CAS: 21667-62-9 Molecular Formula: C9H6ClNO Molecular Weight (g/mol): 179.60 MDL Number: MFCD00067891 InChI Key: IUDFNNHFARLIPF-UHFFFAOYSA-N Synonym: maybridge1_004670, acmc-1cqmb, m-chlorophenacyl cyanide, pubchem12046, beta-ketonitrile 5b, 3-3-chlorophenyl-3-oxo-propanenitrile, 3-chlorobenzoyl acetonitrile, 3-chlorophenacylcyanide, 3-3-chlorophenyl-3-oxopropanenitrile, 3-chlorobenzoylacetonitrile PubChem CID: 140855 IUPAC Name: 3-(3-chlorophenyl)-3-oxopropanenitrile SMILES: ClC1=CC=CC(=C1)C(=O)CC#N

CAS: 1072-82-8 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.128 MDL Number: MFCD00067759 InChI Key: KHHSXHXUQVNBGA-UHFFFAOYSA-N Synonym: 3-acetyl-1h-pyrroline, pubchem22508, 3-acetyl pyrrole, 3-acetyl-1h-pyrrole, 1-1h-pyrrol-3-yl-ethanone, ethanone, 1-1h-pyrrol-3-yl, 1-1h-pyrrol-3-yl ethan-1-one, 1-1h-pyrrol-3-yl ethanone, 3-acetylpyrrole PubChem CID: 2737793 IUPAC Name: 1-(1H-pyrrol-3-yl)ethanone SMILES: CC(=O)C1=CNC=C1

CAS: 100-19-6 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00007355 InChI Key: YQYGPGKTNQNXMH-UHFFFAOYSA-N Synonym: pnap, ethanone, 1-4-nitrophenyl, 1-4-nitrophenyl ethan-1-one, p-nitrophenyl methyl ketone, paranitroacetophenone, p-acetylnitrobenzene, 1-4-nitrophenyl ethanone, 4-nitroacetophenone, 4'-nitroacetophenone, p-nitroacetophenone PubChem CID: 7487 ChEBI: CHEBI:28735 IUPAC Name: 1-(4-nitrophenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)[N+]([O-])=O

CAS: 400-93-1 Molecular Formula: C8H6FNO3 Molecular Weight (g/mol): 183.138 MDL Number: MFCD00115369 InChI Key: PTCNZDJJIOLIKQ-UHFFFAOYSA-N Synonym: 3'-nitro-4'-fluoroacetophenone, 4-fluoro-3-nitroacetophneone, ethanone, 1-4-fluoro-3-nitrophenyl, 4-fluoro-3'-nitroacetophenone, 1-4-fluoro-3-nitro-phenyl ethanone, 1-4-fluoro-3-nitrophenyl ethan-1-one, 4-fluoro-3-nitroacetophenone, 1-4-fluoro-3-nitrophenyl ethanone, 4'-fluoro-3'-nitroacetophenone PubChem CID: 2734612 IUPAC Name: 1-(4-fluoro-3-nitrophenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1)F)[N+](=O)[O-]

CAS: 63131-29-3 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00000355 InChI Key: HGLVYXXPRSNKQN-UHFFFAOYSA-N Synonym: acmc-209nd6, pubchem16721, benzenepropanoic acid, 4-fluoro-.beta.-oxo-, methyl ester, benzenepropanoic acid, 4-fluoro-beta-oxo-, methyl ester, 3-4-fluoro-phenyl-3-oxo-propionic acid methyl ester, methyl 4'-fluorobenzoylacetate, 4-fluorobenzoylacetic acid methyl ester, methyl p-fluorobenzoylacetate, methyl 3-4-fluorophenyl-3-oxopropanoate, methyl 4-fluorobenzoylacetate PubChem CID: 579425 IUPAC Name: methyl 3-(4-fluorophenyl)-3-oxopropanoate SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)F

CAS: 16184-89-7 Molecular Formula: C8H4BrF3O Molecular Weight (g/mol): 253.018 MDL Number: MFCD00191862 InChI Key: IHGSAQHSAGRWNI-UHFFFAOYSA-N Synonym: 4'-bromo-2,2,2-trifluoroaceto-phenone, 4'-bromo-2,2,2-trifluoracetophenone, 4-trifluoroacetylbromobenzene, intermediates-zcf02216, 1-4-bromophenyl-2,2,2-trifluoro-1-ethanone, ethanone, 1-4-bromophenyl-2,2,2-trifluoro, 1-4-bromo-phenyl-2,2,2-trifluoro-ethanone, 1-4-bromophenyl-2,2,2-trifluoroethan-1-one, 1-4-bromophenyl-2,2,2-trifluoroethanone, 4'-bromo-2,2,2-trifluoroacetophenone PubChem CID: 603866 IUPAC Name: 1-(4-bromophenyl)-2,2,2-trifluoroethanone SMILES: C1=CC(=CC=C1C(=O)C(F)(F)F)Br

CAS: 1009-14-9 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00009480 InChI Key: XKGLSKVNOSHTAD-UHFFFAOYSA-N Synonym: valerophenone, 8ci, 1-benzoylbutane, n-butyl phenyl ketone, unii-f27q043nt1, 1-pentanone, 1-phenyl, 1-phenyl-1-pentanone, pentanophenone, butyl phenyl ketone, valerophenone PubChem CID: 66093 ChEBI: CHEBI:36812 IUPAC Name: 1-phenylpentan-1-one SMILES: CCCCC(=O)C1=CC=CC=C1

CAS: 577-56-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00002475 InChI Key: QDAWXRKTSATEOP-UHFFFAOYSA-N Synonym: methyl phenyl ketone-o-carboxylic acid, acetophenone-2'-carboxylic acid, 2'-acetophenonecarboxylic acid, 3-hydroxy-3-methylphthalide, benzoic acid, acetyl, 2-acetyl-benzoic acid, acetophenone-2-carboxylic acid, 2-acetylbenzoicacid, benzoic acid, 2-acetyl, o-acetylbenzoic acid PubChem CID: 68474 IUPAC Name: 2-acetylbenzoic acid SMILES: CC(=O)C1=CC=CC=C1C(O)=O

CAS: 551-93-9 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007717 InChI Key: GTDQGKWDWVUKTI-UHFFFAOYSA-N Synonym: ethanone, 1-2-aminophenyl, acetophenone, 2'-amino, 1-2-aminophenyl ethan-1-one, 1-acetyl-2-aminobenzene, o-aminoacetylbenzene, o-acetylaniline, 2-acetylaniline, o-aminoacetophenone, 1-2-aminophenyl ethanone, 2'-aminoacetophenone PubChem CID: 11086 IUPAC Name: 1-(2-aminophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1N

CAS: 68755-42-0 Molecular Formula: C10H7F3O Molecular Weight (g/mol): 200.16 MDL Number: MFCD07772121 InChI Key: LJVBFMQEZSEGRL-UHFFFAOYSA-N Synonym: 2,3-dihydro-4-trifluoromethyl-1h-inden-1-one, acmc-1b8x3, 2,3-dihydro-4-trifluoromethyl-1h-inden-1-one, 2,3-dihydro-1-oxo-4-trifluoromethyl-1h-indene, 4-trifluoromethyl indan-1-one, 1h-inden-1-one, 2,3-dihydro-4-trifluoromethyl, 4-trifluoromethyl-2,3-dihydroinden-1-one, 4-trifluoromethyl-2,3-dihydro-1h-inden-1-one, 4-trifluoromethyl-1-indanone PubChem CID: 21921093 IUPAC Name: 4-(trifluoromethyl)-2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=C1C(=CC=C2)C(F)(F)F

CAS: 175137-02-7 Molecular Formula: C12H10ClNOS Molecular Weight (g/mol): 251.73 MDL Number: MFCD00068162 InChI Key: DLQVOIFYJQATMI-UHFFFAOYSA-N Synonym: 1-3-amino-5-4-chlorophenyl thiophen-2-yl ethan-1-one, ethanone,1-3-amino-5-4-chlorophenyl-2-thienyl, 2-acetyl-3-amino-5-4-chlorophenyl thiophene, 1-3-amino-5-4-chlorophenyl thiophen-2-yl ethanone, 1-3-amino-5-4-chlorophenyl-2-thienyl ethan-1-one PubChem CID: 2777494 SMILES: CC(=O)C1=C(N)C=C(S1)C1=CC=C(Cl)C=C1

CAS: 99-91-2 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.59 MDL Number: MFCD00000624 InChI Key: BUZYGTVTZYSBCU-UHFFFAOYSA-N Synonym: p-acetylchlorobenzene, p-chloracetophenone, 4-acetylchlorobenzene, 1-4-chlorophenyl ethan-1-one, acetophenone, 4'-chloro, ethanone, 1-4-chlorophenyl, p-chloroacetophenone, 4-chloroacetophenone, 1-4-chlorophenyl ethanone, 4'-chloroacetophenone PubChem CID: 7467 ChEBI: CHEBI:27538 IUPAC Name: 1-(4-chlorophenyl)ethanone SMILES: CC(=O)C1=CC=C(Cl)C=C1

CAS: 611-09-6 Molecular Formula: C₈H₄N₂O₄ Molecular Weight (g/mol): 192.13 MDL Number: MFCD00005720 InChI Key: UNMYHYODJHKLOC-UHFFFAOYSA-N Synonym: 5-nitro-2,3-dihydro-1h-indole-2,3-dione, 2,3-dihydro-5-nitroindole-2,3-dione, ccris 4031, n-nitroisatin, isatin, 5-nitro, indole-2,3-dione, 5-nitro, 1h-indole-2,3-dione, 5-nitro, 5-nitroindole-2,3-dione, 5-nitroindoline-2,3-dione, 5-nitroisatin PubChem CID: 4669250 IUPAC Name: 5-nitro-1H-indole-2,3-dione SMILES: C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2

CAS: 6008-36-2 Molecular Formula: C15H22O Molecular Weight (g/mol): 218.34 MDL Number: MFCD00048965 InChI Key: PFUPABFCHVRLLY-UHFFFAOYSA-N Synonym: acmc-209mhy, 1-phenyl-nonan-1-one, 1-nonanone, 1-phenyl, 1-phenyl-1-nonanone, n-octyl phenyl ketone, n-nonanophenone, nonanophenone PubChem CID: 80108 IUPAC Name: 1-phenylnonan-1-one SMILES: CCCCCCCCC(=O)C1=CC=CC=C1

CAS: 2040-05-3 MDL Number: MFCD00016339

CAS: 50916-55-7 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.06 MDL Number: MFCD00833267 InChI Key: XWCGNFLHRINYCE-UHFFFAOYSA-N Synonym: 3-bromoacetyl-benzonitrile, benzonitrile, 3-bromoacetyl, 3-2-bromo-acetyl-benzonitrile, 3-bromoacetyl benzonitrile, 3-2-bromoacetyl benzenecarbonitrile, 2-bromo-3'-cyanoacetophenone, 3-cyanophenacylbromide, 3-cyanophenacyl bromide, 3-2-bromoacetyl benzonitrile PubChem CID: 2735867 IUPAC Name: 3-(2-bromoacetyl)benzonitrile SMILES: BrCC(=O)C1=CC=CC(=C1)C#N

CAS: 24295-03-2 Molecular Formula: C5H5NOS Molecular Weight (g/mol): 127.161 MDL Number: MFCD00005324 InChI Key: MOMFXATYAINJML-UHFFFAOYSA-N Synonym: 1-thiazol-2-yl-ethanone, 2-acetyl-1,3-thiazole, 2-acetylthiazol, ketone, methyl 2-thiazolyl, 1-2-thiazolyl ethanone, 2-acetyl thiazole, 1-1,3-thiazol-2-yl ethanone, ethanone, 1-2-thiazolyl, 1-1,3-thiazol-2-yl ethan-1-one, 2-acetylthiazole PubChem CID: 520108 IUPAC Name: 1-(1,3-thiazol-2-yl)ethanone SMILES: CC(=O)C1=NC=CS1

CAS: 14035-33-7 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD00017520 InChI Key: WGJPGMJLARWHRK-UHFFFAOYSA-N Synonym: cbmicro_019190, 1-acetyl-3,5-bis tert-butyl-4-hydroxybenzene, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl ethanone, ethanone, 1-3,5-bis 1,1-dimethylethyl-4-hydroxyphenyl, 1-3,5-di-tert-butyl-4-hydroxyphenyl ethan-1-one, 3,5-di-tert-butyl-4-hydroxyacetophenone, 3',5'-di-tert-butyl-4'-hydroxyacetophenone, 1-3,5-di tert-butyl-4-hydroxyphenyl ethan-1-one, 1-3,5-ditert-butyl-4-hydroxyphenyl ethanone, 1-3,5-di-tert-butyl-4-hydroxyphenyl ethanone PubChem CID: 616296 IUPAC Name: 1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C

CAS: 838-57-3 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.211 MDL Number: MFCD00007357 InChI Key: NGRXSVFCLHVGKU-UHFFFAOYSA-N Synonym: benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester, 4-nitrobenzoyl acetic acid ethyl ester, ethyl 4-nitro-beta-oxobenzenepropanoate, 4-nitrobenzoylacetic acid ethyl ester, ethyl p-nitrobenzoylacetate, p-nitrobenzoyl acetic acid ethyl ester, ethyl 4-nitrobenzoyl acetate, ethyl p-nitrobenzoyl acetate, ethyl 3-4-nitrophenyl-3-oxopropanoate, ethyl 4-nitrobenzoylacetate PubChem CID: 13281 IUPAC Name: ethyl 3-(4-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]