Complex Ketones

Organic compounds that contain one or more ketone functional groups; a ketone functional group consists of a carbonyl with a carbon atom, or other functional group adjacent to each side.

16 – 30 of 2,783 results

1-Bromo-2-butanone, 90%, stabilized, Thermo Scientific Chemicals

CAS: 816-40-0 Molecular Formula: C₄H₇BrO Molecular Weight (g/mol): 151 MDL Number: MFCD00000207 InChI Key: CCXQVBSQUQCEEO-UHFFFAOYSA-N Synonym: 1-bromo-2-butanone,2-butanone, 1-bromo,1-bromobutanone,bromomethyl ethyl ketone,bromobutanone,bromobutan-2-one,l-bromo-2-butanone,acmc-20aoxd,1-bromo-butan-2-one PubChem CID: 13156 IUPAC Name: 1-bromobutan-2-one SMILES: CCC(=O)CBr

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Specifications

PubChem CID	13156
CAS	816-40-0
Molecular Weight (g/mol)	151
MDL Number	MFCD00000207
SMILES	CCC(=O)CBr
Synonym	1-bromo-2-butanone,2-butanone, 1-bromo,1-bromobutanone,bromomethyl ethyl ketone,bromobutanone,bromobutan-2-one,l-bromo-2-butanone,acmc-20aoxd,1-bromo-butan-2-one
IUPAC Name	1-bromobutan-2-one
InChI Key	CCXQVBSQUQCEEO-UHFFFAOYSA-N
Molecular Formula	C₄H₇BrO

L-1-4'-Tosylamino-2-phenylethyl chloromethyl ketone, 99+%

CAS: 402-71-1 Molecular Formula: C17H18ClNO3S Molecular Weight (g/mol): 351.85 MDL Number: MFCD00000935 InChI Key: MQUQNUAYKLCRME-INIZCTEOSA-N Synonym: tpck,tos-phe-ch2cl,tosylphenylalanyl chloromethyl ketone,n-tosyl-l-phenylalanyl chloromethyl ketone,n-tosyl-l-phenylalanine chloromethyl ketone,n-p-tosyl-l-phenylalanine chloromethyl ketone,l-1-tosylamido-2-phenylethyl chloromethyl ketone,l-n-alpha-chloroacetyl phenethyl-p-toluenesulfonamide,tos-phe-chloromethylketone,chembl60718 PubChem CID: 439647 ChEBI: CHEBI:9642 IUPAC Name: N-[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]-4-methylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC1=CC=CC=C1)C(=O)CCl

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Specifications

PubChem CID	439647
CAS	402-71-1
Molecular Weight (g/mol)	351.85
ChEBI	CHEBI:9642
MDL Number	MFCD00000935
SMILES	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC1=CC=CC=C1)C(=O)CCl
Synonym	tpck,tos-phe-ch2cl,tosylphenylalanyl chloromethyl ketone,n-tosyl-l-phenylalanyl chloromethyl ketone,n-tosyl-l-phenylalanine chloromethyl ketone,n-p-tosyl-l-phenylalanine chloromethyl ketone,l-1-tosylamido-2-phenylethyl chloromethyl ketone,l-n-alpha-chloroacetyl phenethyl-p-toluenesulfonamide,tos-phe-chloromethylketone,chembl60718
IUPAC Name	N-[(2S)-4-chloro-3-oxo-1-phenylbutan-2-yl]-4-methylbenzenesulfonamide
InChI Key	MQUQNUAYKLCRME-INIZCTEOSA-N
Molecular Formula	C17H18ClNO3S

Purpurin

CAS: 81-54-9 Molecular Formula: C₁₄H₈O₅ Molecular Weight (g/mol): 256.2 MDL Number: MFCD00001203 InChI Key: BBNQQADTFFCFGB-UHFFFAOYSA-N Synonym: purpurin,1,2,4-trihydroxyanthraquinone,purpurine,verantin,hydroxylizaric acid,smoke brown g,1,2,4-trihydroxy-9,10-anthracenedione,1,2,4-trihydroxy-9,10-anthraquinone,1,2,4-trihydroxyanthrachinon,9,10-anthracenedione, 1,2,4-trihydroxy PubChem CID: 6683 ChEBI: CHEBI:8645 IUPAC Name: 1,2,4-trihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O

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Specifications

PubChem CID	6683
CAS	81-54-9
Molecular Weight (g/mol)	256.2
ChEBI	CHEBI:8645
MDL Number	MFCD00001203
SMILES	C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3O)O)O
Synonym	purpurin,1,2,4-trihydroxyanthraquinone,purpurine,verantin,hydroxylizaric acid,smoke brown g,1,2,4-trihydroxy-9,10-anthracenedione,1,2,4-trihydroxy-9,10-anthraquinone,1,2,4-trihydroxyanthrachinon,9,10-anthracenedione, 1,2,4-trihydroxy
IUPAC Name	1,2,4-trihydroxyanthracene-9,10-dione
InChI Key	BBNQQADTFFCFGB-UHFFFAOYSA-N
Molecular Formula	C₁₄H₈O₅

Ethyl 3,3,3-trifluoropyruvate, 98+%

CAS: 13081-18-0 Molecular Formula: C5H5F3O3 Molecular Weight (g/mol): 170.09 MDL Number: MFCD00114935 InChI Key: KJHQVUNUOIEYSV-UHFFFAOYSA-N Synonym: ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013 PubChem CID: 2737239 IUPAC Name: ethyl 3,3,3-trifluoro-2-oxopropanoate SMILES: CCOC(=O)C(=O)C(F)(F)F

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Specifications

PubChem CID	2737239
CAS	13081-18-0
Molecular Weight (g/mol)	170.09
MDL Number	MFCD00114935
SMILES	CCOC(=O)C(=O)C(F)(F)F
Synonym	ethyl trifluoropyruvate,ethyltrifluoropyruvate,ethyl 3,3,3-trifluoropyruvate,trifluoropyruvic acid ethyl ester,propanoic acid, 3,3,3-trifluoro-2-oxo-, ethyl ester,ethyl 2-oxo-3,3,3-trifluoropropanoate,3,3,3-trifluoro-2-oxopropanoic acid ethyl ester,ethyl trifluorpyruvate,ethyl-trifluoropyruvate,pubchem2013
IUPAC Name	ethyl 3,3,3-trifluoro-2-oxopropanoate
InChI Key	KJHQVUNUOIEYSV-UHFFFAOYSA-N
Molecular Formula	C5H5F3O3

2-Amino-4'-methoxyacetophenone hydrochloride, 97%

CAS: 3883-94-1 Molecular Formula: C₉H₁₁NO₂·ClH Molecular Weight (g/mol): 201.65 MDL Number: MFCD00193078 InChI Key: FZVYWBMMOSHMRS-UHFFFAOYSA-N Synonym: 2-amino-1-4-methoxyphenyl ethanone hydrochloride,2-amino-4'-methoxyacetophenone hydrochloride,2-amino-1-4-methoxyphenyl ethan-1-one hydrochloride,4-methoxyphenacylamine hydrochloride,ethanone, 2-amino-1-4-methoxyphenyl-, hydrochloride,2-amino-1-4-methoxyphenyl ethan-1-one, chloride,pubchem22350,acmc-1ad40,4-aminoacetyl anisole hydrochloride,2-amino-4-methoxyacetophenone hydrochloride PubChem CID: 12487188 IUPAC Name: 2-amino-1-(4-methoxyphenyl)ethanone;hydrochloride SMILES: COC1=CC=C(C=C1)C(=O)CN.Cl

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Specifications

PubChem CID	12487188
CAS	3883-94-1
Molecular Weight (g/mol)	201.65
MDL Number	MFCD00193078
SMILES	COC1=CC=C(C=C1)C(=O)CN.Cl
Synonym	2-amino-1-4-methoxyphenyl ethanone hydrochloride,2-amino-4'-methoxyacetophenone hydrochloride,2-amino-1-4-methoxyphenyl ethan-1-one hydrochloride,4-methoxyphenacylamine hydrochloride,ethanone, 2-amino-1-4-methoxyphenyl-, hydrochloride,2-amino-1-4-methoxyphenyl ethan-1-one, chloride,pubchem22350,acmc-1ad40,4-aminoacetyl anisole hydrochloride,2-amino-4-methoxyacetophenone hydrochloride
IUPAC Name	2-amino-1-(4-methoxyphenyl)ethanone;hydrochloride
InChI Key	FZVYWBMMOSHMRS-UHFFFAOYSA-N
Molecular Formula	C₉H₁₁NO₂·ClH

Methyl 4-trifluoromethylbenzoylacetate, 95%, Thermo Scientific™

CAS: 212755-76-5 Molecular Formula: C11H9F3O3 Molecular Weight (g/mol): 246.19 MDL Number: MFCD00216521 InChI Key: NMJOILIYLOHXGP-UHFFFAOYSA-N Synonym: methyl 4-trifluoromethyl benzoylacetate,methyl 4-trifluoromethylbenzoylacetate,methyl 3-oxo-3-4-trifluoromethyl phenyl propanoate,3-oxo-3-4-trifluoromethylphenyl propionic acid methyl ester,methyl 3-4-trifluoromethyl phenyl-3-oxopropanoate,pubchem2696,buttpark 18\10-41,methyl 4-trifluoromethyl benzoyl acetate PubChem CID: 735882 IUPAC Name: methyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate SMILES: COC(=O)CC(=O)C1=CC=C(C=C1)C(F)(F)F

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Specifications

PubChem CID	735882
CAS	212755-76-5
Molecular Weight (g/mol)	246.19
MDL Number	MFCD00216521
SMILES	COC(=O)CC(=O)C1=CC=C(C=C1)C(F)(F)F
Synonym	methyl 4-trifluoromethyl benzoylacetate,methyl 4-trifluoromethylbenzoylacetate,methyl 3-oxo-3-4-trifluoromethyl phenyl propanoate,3-oxo-3-4-trifluoromethylphenyl propionic acid methyl ester,methyl 3-4-trifluoromethyl phenyl-3-oxopropanoate,pubchem2696,buttpark 18\10-41,methyl 4-trifluoromethyl benzoyl acetate
IUPAC Name	methyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate
InChI Key	NMJOILIYLOHXGP-UHFFFAOYSA-N
Molecular Formula	C11H9F3O3

2-Bromo-3'-nitroacetophenone, 97%

CAS: 2227-64-7 Molecular Formula: C₈H₆BrNO₃ Molecular Weight (g/mol): 244.04 MDL Number: MFCD00024512 InChI Key: GZHPNIQBPGUSSX-UHFFFAOYSA-N Synonym: 2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide PubChem CID: 75213 IUPAC Name: 2-bromo-1-(3-nitrophenyl)ethanone SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr

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Specifications

PubChem CID	75213
CAS	2227-64-7
Molecular Weight (g/mol)	244.04
MDL Number	MFCD00024512
SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)CBr
Synonym	2-bromo-1-3-nitrophenyl ethanone,2-bromo-3'-nitroacetophenone,3-nitrophenacyl bromide,3-nitrophenacylbromide,2-bromo-1-3-nitrophenyl ethan-1-one,a-bromo-3-nitroacetophenone,2-bromo-3-nitroacetophenone,alpha-bromo-3'-nitroacetophenone,acetophenone, 2-bromo-3'-nitro,m-nitrophenacyl bromide
IUPAC Name	2-bromo-1-(3-nitrophenyl)ethanone
InChI Key	GZHPNIQBPGUSSX-UHFFFAOYSA-N
Molecular Formula	C₈H₆BrNO₃

4-Benzoylpyridine, 98%

CAS: 14548-46-0 Molecular Formula: C₁₂H₉NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00006430 InChI Key: SKFLCXNDKRUHTA-UHFFFAOYSA-N Synonym: 4-benzoylpyridine,phenyl pyridin-4-yl methanone,phenyl 4-pyridyl ketone,methanone, phenyl-4-pyridinyl,phenyl 4-pyridinyl methanone,4-pyridyl phenyl ketone,pyridine, 4-benzoyl,ketone, phenyl 4-pyridyl,gamma-benzoylpyridine,4-benzoyl pyridine PubChem CID: 26731 IUPAC Name: phenyl(pyridin-4-yl)methanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=NC=C2

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Specifications

PubChem CID	26731
CAS	14548-46-0
Molecular Weight (g/mol)	183.21
MDL Number	MFCD00006430
SMILES	C1=CC=C(C=C1)C(=O)C2=CC=NC=C2
Synonym	4-benzoylpyridine,phenyl pyridin-4-yl methanone,phenyl 4-pyridyl ketone,methanone, phenyl-4-pyridinyl,phenyl 4-pyridinyl methanone,4-pyridyl phenyl ketone,pyridine, 4-benzoyl,ketone, phenyl 4-pyridyl,gamma-benzoylpyridine,4-benzoyl pyridine
IUPAC Name	phenyl(pyridin-4-yl)methanone
InChI Key	SKFLCXNDKRUHTA-UHFFFAOYSA-N
Molecular Formula	C₁₂H₉NO

4-Acetylbenzonitrile, 98+%

CAS: 1443-80-7 Molecular Formula: C₉H₇NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00001825 InChI Key: NLPHXWGWBKZSJC-UHFFFAOYSA-N Synonym: 4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile PubChem CID: 74044 IUPAC Name: 4-acetylbenzonitrile SMILES: CC(=O)C1=CC=C(C=C1)C#N

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Specifications

PubChem CID	74044
CAS	1443-80-7
Molecular Weight (g/mol)	145.16
MDL Number	MFCD00001825
SMILES	CC(=O)C1=CC=C(C=C1)C#N
Synonym	4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile
IUPAC Name	4-acetylbenzonitrile
InChI Key	NLPHXWGWBKZSJC-UHFFFAOYSA-N
Molecular Formula	C₉H₇NO

Ethyl benzoylacetate, 90%

CAS: 94-02-0 Molecular Formula: C₁₁H₁₂O₃ Molecular Weight (g/mol): 192.21 MDL Number: MFCD00009196 InChI Key: GKKZMYDNDDMXSE-UHFFFAOYSA-N Synonym: ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate PubChem CID: 7170 IUPAC Name: ethyl 3-oxo-3-phenylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1

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Specifications

PubChem CID	7170
CAS	94-02-0
Molecular Weight (g/mol)	192.21
MDL Number	MFCD00009196
SMILES	CCOC(=O)CC(=O)C1=CC=CC=C1
Synonym	ethyl benzoylacetate,benzoylacetic acid ethyl ester,ethyl benzoyl acetate,acetic acid, benzoyl-, ethyl ester,ethyl beta-oxobenzenepropanoate,ethylbenzoylacetate,benzoylacetic acid, ethyl ester,ethyl 3-phenyl-3-oxopropanoate,benzenepropanoic acid, beta-oxo-, ethyl ester,ethyl 3-oxo-3-phenylpropionate
IUPAC Name	ethyl 3-oxo-3-phenylpropanoate
InChI Key	GKKZMYDNDDMXSE-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₂O₃

4'-Ethynylacetophenone, 98%

CAS: 42472-69-5 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.17 MDL Number: MFCD04974025 InChI Key: WHFPFLKZXFBCSO-UHFFFAOYSA-N PubChem CID: 5123626 IUPAC Name: 1-(4-ethynylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C#C

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Specifications

PubChem CID	5123626
CAS	42472-69-5
Molecular Weight (g/mol)	144.17
MDL Number	MFCD04974025
SMILES	CC(=O)C1=CC=C(C=C1)C#C
IUPAC Name	1-(4-ethynylphenyl)ethanone
InChI Key	WHFPFLKZXFBCSO-UHFFFAOYSA-N
Molecular Formula	C10H8O

4'-Chloro-2'-hydroxyacetophenone, 97%

CAS: 6921-66-0 Molecular Formula: C₈H₇ClO₂ Molecular Weight (g/mol): 170.59 InChI Key: QCVSDCHNBNFJDQ-UHFFFAOYSA-N Synonym: 1-4-chloro-2-hydroxyphenyl ethanone,4'-chloro-2'-hydroxyacetophenone,4-chloro-2-hydroxyacetophenone,1-4-chloro-2-hydroxyphenyl ethan-1-one,2'-hydroxy-4'-chloroacetophenone,1-4-chloro-2-hydroxy-phenyl ethanone,ethanone, 1-4-chloro-2-hydroxyphenyl,4'-chloro-2'-hydroxy-acetophenone,ethanone,1-4-chloro-2-hydroxyphenyl PubChem CID: 1051513 IUPAC Name: 1-(4-chloro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)Cl)O

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Specifications

PubChem CID	1051513
CAS	6921-66-0
Molecular Weight (g/mol)	170.59
SMILES	CC(=O)C1=C(C=C(C=C1)Cl)O
Synonym	1-4-chloro-2-hydroxyphenyl ethanone,4'-chloro-2'-hydroxyacetophenone,4-chloro-2-hydroxyacetophenone,1-4-chloro-2-hydroxyphenyl ethan-1-one,2'-hydroxy-4'-chloroacetophenone,1-4-chloro-2-hydroxy-phenyl ethanone,ethanone, 1-4-chloro-2-hydroxyphenyl,4'-chloro-2'-hydroxy-acetophenone,ethanone,1-4-chloro-2-hydroxyphenyl
IUPAC Name	1-(4-chloro-2-hydroxyphenyl)ethanone
InChI Key	QCVSDCHNBNFJDQ-UHFFFAOYSA-N
Molecular Formula	C₈H₇ClO₂

4'-Methoxypropiophenone, 99%

CAS: 121-97-1 Molecular Formula: C₁₀H₁₂O₂ Molecular Weight (g/mol): 164.2 MDL Number: MFCD00009310 InChI Key: ZJVAWPKTWVFKHG-UHFFFAOYSA-N PubChem CID: 67144 IUPAC Name: 1-(4-methoxyphenyl)propan-1-one SMILES: CCC(=O)C1=CC=C(C=C1)OC

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Specifications

PubChem CID	67144
CAS	121-97-1
Molecular Weight (g/mol)	164.2
MDL Number	MFCD00009310
SMILES	CCC(=O)C1=CC=C(C=C1)OC
IUPAC Name	1-(4-methoxyphenyl)propan-1-one
InChI Key	ZJVAWPKTWVFKHG-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₂O₂

2-Bromo-4'-cyanoacetophenone, 97%

CAS: 20099-89-2 Molecular Formula: C₉H₆BrNO Molecular Weight (g/mol): 224.06 MDL Number: MFCD00052931 InChI Key: LJANCPRIUMHGJE-UHFFFAOYSA-N Synonym: 4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile PubChem CID: 98654 IUPAC Name: 4-(2-bromoacetyl)benzonitrile SMILES: C1=CC(=CC=C1C#N)C(=O)CBr

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Specifications

PubChem CID	98654
CAS	20099-89-2
Molecular Weight (g/mol)	224.06
MDL Number	MFCD00052931
SMILES	C1=CC(=CC=C1C#N)C(=O)CBr
Synonym	4-2-bromoacetyl benzonitrile,4-cyanophenacyl bromide,4-bromoacetyl benzonitrile,2-bromo-4'-cyanoacetophenone,benzonitrile, 4-bromoacetyl,p-cyanophenacyl bromide,4-2-bromo-acetyl-benzonitrile,4-2-bromoethanoyl benzonitrile,4-2-bromoacetyl benzenecarbonitrile
IUPAC Name	4-(2-bromoacetyl)benzonitrile
InChI Key	LJANCPRIUMHGJE-UHFFFAOYSA-N
Molecular Formula	C₉H₆BrNO

3'-Hydroxyacetophenone, 99+%

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

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Specifications

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

Complex Ketones

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