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.

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106 – 120 of 2,844 results

106

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Ethyl trifluoroacetoacetate, 97%

CAS: 372-31-6 Molecular Formula: C6H7F3O3 Molecular Weight (g/mol): 184.114 MDL Number: MFCD00000424 InChI Key: OCJKUQIPRNZDTK-UHFFFAOYSA-N Synonym: ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester PubChem CID: 67793 IUPAC Name: ethyl 4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)C(F)(F)F

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Specifications

PubChem CID	67793
CAS	372-31-6
Molecular Weight (g/mol)	184.114
MDL Number	MFCD00000424
SMILES	CCOC(=O)CC(=O)C(F)(F)F
Synonym	ethyl 4,4,4-trifluoroacetoacetate,ethyl trifluoroacetoacetate,butanoic acid, 4,4,4-trifluoro-3-oxo-, ethyl ester,4,4,4-trifluoro-3-oxobutanoic acid ethyl ester,ethyl trifluoroacetyl acetate,etfaa,4,4,4-trifluoroacetoacetic acid ethyl ester,ethyl-4,4,4-trifluoroacetoacetate,trifluoroacetoacetic acid ethyl ester,4,4,4-trifluoro-3-oxo-butyric acid ethyl ester
IUPAC Name	ethyl 4,4,4-trifluoro-3-oxobutanoate
InChI Key	OCJKUQIPRNZDTK-UHFFFAOYSA-N
Molecular Formula	C6H7F3O3

107

N1-(3-acetyl-4-hydroxyphenyl)acetamide, Thermo Scientific™

CAS: 7298-67-1 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 InChI Key: DIQSYMRVTOVKQT-UHFFFAOYSA-N Synonym: n-3-acetyl-4-hydroxyphenyl acetamide,n1-3-acetyl-4-hydroxyphenyl acetamide,n-3-acetyl-4-hydroxy-phenyl acetamide,5'-acetamido-2'-hydroxyacetophenone,acetamide, n-3-acetyl-4-hydroxyphenyl,ksc380g7h,3'-acetyl-4'-hydroxyacetanilide,5-acetamido-2-hydroxyacetophenone,5-acetamido-2-hydroxy-acetophenone,n-3-acetyl-4-hydroxyphenyl-acetamide PubChem CID: 81720 IUPAC Name: N-(3-acetyl-4-hydroxyphenyl)acetamide SMILES: CC(=O)C1=C(C=CC(=C1)NC(=O)C)O

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Specifications

PubChem CID	81720
CAS	7298-67-1
Molecular Weight (g/mol)	193.202
SMILES	CC(=O)C1=C(C=CC(=C1)NC(=O)C)O
Synonym	n-3-acetyl-4-hydroxyphenyl acetamide,n1-3-acetyl-4-hydroxyphenyl acetamide,n-3-acetyl-4-hydroxy-phenyl acetamide,5'-acetamido-2'-hydroxyacetophenone,acetamide, n-3-acetyl-4-hydroxyphenyl,ksc380g7h,3'-acetyl-4'-hydroxyacetanilide,5-acetamido-2-hydroxyacetophenone,5-acetamido-2-hydroxy-acetophenone,n-3-acetyl-4-hydroxyphenyl-acetamide
IUPAC Name	N-(3-acetyl-4-hydroxyphenyl)acetamide
InChI Key	DIQSYMRVTOVKQT-UHFFFAOYSA-N
Molecular Formula	C10H11NO3

108

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3-Acetylpyridine, 98%

CAS: 350-03-8 Molecular Formula: C₇H₇NO Molecular Weight (g/mol): 121.14 MDL Number: MFCD00006396 InChI Key: WEGYGNROSJDEIW-UHFFFAOYSA-N Synonym: 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one PubChem CID: 9589 IUPAC Name: 1-pyridin-3-ylethanone SMILES: CC(=O)C1=CN=CC=C1

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Specifications

PubChem CID	9589
CAS	350-03-8
Molecular Weight (g/mol)	121.14
MDL Number	MFCD00006396
SMILES	CC(=O)C1=CN=CC=C1
Synonym	3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one
IUPAC Name	1-pyridin-3-ylethanone
InChI Key	WEGYGNROSJDEIW-UHFFFAOYSA-N
Molecular Formula	C₇H₇NO

109

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2-Acetylfuran, 99%

CAS: 1192-62-7 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00003242 InChI Key: IEMMBWWQXVXBEU-UHFFFAOYSA-N Synonym: 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl PubChem CID: 14505 ChEBI: CHEBI:59983 IUPAC Name: 1-(furan-2-yl)ethanone SMILES: CC(=O)C1=CC=CO1

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Specifications

PubChem CID	14505
CAS	1192-62-7
Molecular Weight (g/mol)	110.112
ChEBI	CHEBI:59983
MDL Number	MFCD00003242
SMILES	CC(=O)C1=CC=CO1
Synonym	2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl
IUPAC Name	1-(furan-2-yl)ethanone
InChI Key	IEMMBWWQXVXBEU-UHFFFAOYSA-N
Molecular Formula	C6H6O2

110

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Bupropion Hydrochloride, USP, 98-102%, Spectrum™ Chemical

CAS: 31677-93-7 Molecular Formula: C13H19Cl2NO Molecular Weight (g/mol): 276.20 InChI Key: HEYVINCGKDONRU-UHFFFAOYNA-N IUPAC Name: hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride SMILES: [H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1

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Specifications

CAS	31677-93-7
Molecular Weight (g/mol)	276.20
SMILES	[H+].[Cl-].CC(NC(C)(C)C)C(=O)C1=CC=CC(Cl)=C1
IUPAC Name	hydrogen 2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one chloride
InChI Key	HEYVINCGKDONRU-UHFFFAOYNA-N
Molecular Formula	C13H19Cl2NO

111

Thermo Scientific Chemicals D-Sorbose, 98%

CAS: 3615-56-3 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00151095 InChI Key: LKDRXBCSQODPBY-IANNHFEVSA-N Synonym: d-sorbose,keto-d-sorbose,unii-jj09461njs,3r,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,xylo-hexulose,sorbose, d,d-sor,d-xylo-hex-2-ulose,d-+-sorbose PubChem CID: 107428 ChEBI: CHEBI:13022 SMILES: OCC1(O)OC[C@@H](O)[C@H](O)[C@H]1O

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Specifications

PubChem CID	107428
CAS	3615-56-3
Molecular Weight (g/mol)	180.16
ChEBI	CHEBI:13022
MDL Number	MFCD00151095
SMILES	OCC1(O)OC[C@@H](O)[C@H](O)[C@H]1O
Synonym	d-sorbose,keto-d-sorbose,unii-jj09461njs,3r,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,xylo-hexulose,sorbose, d,d-sor,d-xylo-hex-2-ulose,d-+-sorbose
InChI Key	LKDRXBCSQODPBY-IANNHFEVSA-N
Molecular Formula	C6H12O6

112

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2-Hexanoylfuran, 99%

CAS: 14360-50-0 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00037354 InChI Key: YUAYWSBSIJVIBS-UHFFFAOYSA-N Synonym: 2-hexanoylfuran,2-furyl pentyl ketone,1-hexanone, 1-2-furanyl,pentyl 2-furyl ketone,1-2-furyl-1-hexanone,1-furan-2-yl hexan-1-one,1-2-furyl hexanone,2-furyl n-pentyl ketone,1-2-furanyl-1-hexanone,furan, 2-hexanoyl PubChem CID: 61738 IUPAC Name: 1-(furan-2-yl)hexan-1-one SMILES: CCCCCC(=O)C1=CC=CO1

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Specifications

PubChem CID	61738
CAS	14360-50-0
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00037354
SMILES	CCCCCC(=O)C1=CC=CO1
Synonym	2-hexanoylfuran,2-furyl pentyl ketone,1-hexanone, 1-2-furanyl,pentyl 2-furyl ketone,1-2-furyl-1-hexanone,1-furan-2-yl hexan-1-one,1-2-furyl hexanone,2-furyl n-pentyl ketone,1-2-furanyl-1-hexanone,furan, 2-hexanoyl
IUPAC Name	1-(furan-2-yl)hexan-1-one
InChI Key	YUAYWSBSIJVIBS-UHFFFAOYSA-N
Molecular Formula	C10H14O2

113

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4-Benzoylbutyric acid, 97%

CAS: 1501-05-9 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00004411 InChI Key: SHKWSBAVRQZYLE-UHFFFAOYSA-N Synonym: 4-benzoylbutyric acid,5-oxo-5-phenylvaleric acid,benzenepentanoic acid, .delta.-oxo,4-benzoyl-butyric acid,timtec-bb sbb007811,5-oxo-5-phenyl-pentanoic acid,4-benzoylbutyric acid;4-benzoylbutanoic acid,butanoic acid, 4-benzoyl,4-benzoylbutyricacid PubChem CID: 73914 IUPAC Name: 5-oxo-5-phenylpentanoic acid SMILES: C1=CC=C(C=C1)C(=O)CCCC(=O)O

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Specifications

PubChem CID	73914
CAS	1501-05-9
Molecular Weight (g/mol)	192.214
MDL Number	MFCD00004411
SMILES	C1=CC=C(C=C1)C(=O)CCCC(=O)O
Synonym	4-benzoylbutyric acid,5-oxo-5-phenylvaleric acid,benzenepentanoic acid, .delta.-oxo,4-benzoyl-butyric acid,timtec-bb sbb007811,5-oxo-5-phenyl-pentanoic acid,4-benzoylbutyric acid;4-benzoylbutanoic acid,butanoic acid, 4-benzoyl,4-benzoylbutyricacid
IUPAC Name	5-oxo-5-phenylpentanoic acid
InChI Key	SHKWSBAVRQZYLE-UHFFFAOYSA-N
Molecular Formula	C11H12O3

114

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3-(Bromoacetyl)pyridine hydrobromide, 98%

CAS: 17694-68-7 Molecular Formula: C7H7Br2NO Molecular Weight (g/mol): 280.95 MDL Number: MFCD00052182 InChI Key: WDTSYONULAZKIE-UHFFFAOYSA-N Synonym: 2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide PubChem CID: 2776234 IUPAC Name: 2-bromo-1-pyridin-3-ylethanone;hydrobromide SMILES: [H+].[Br-].BrCC(=O)C1=CC=CN=C1

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Specifications

PubChem CID	2776234
CAS	17694-68-7
Molecular Weight (g/mol)	280.95
MDL Number	MFCD00052182
SMILES	[H+].[Br-].BrCC(=O)C1=CC=CN=C1
Synonym	2-bromo-1-pyridin-3-yl ethanone hydrobromide,3-bromoacetyl pyridine hydrobromide,3-2-bromoacetyl pyridine hydrobromide,2-bromo-1-3-pyridinyl ethanone hydrobromide,3-bromoacetyl pyridinium bromide,3-bromoacetyl pyridine hbr,2-bromo-1-pyridin-3-ylethan-1-one hydrobromide,2-bromo-1-pyridin-3-ylethanone hydrobromide,3-bromoacetylpyridine hydrobromide
IUPAC Name	2-bromo-1-pyridin-3-ylethanone;hydrobromide
InChI Key	WDTSYONULAZKIE-UHFFFAOYSA-N
Molecular Formula	C7H7Br2NO

115

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4'-Iodoacetophenone, 98%

CAS: 13329-40-3 Molecular Formula: C₈H₇IO Molecular Weight (g/mol): 246.05 MDL Number: MFCD00045320 InChI Key: JZJWCDQGIPQBAO-UHFFFAOYSA-N Synonym: 4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone PubChem CID: 72869 IUPAC Name: 1-(4-iodophenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)I

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Specifications

PubChem CID	72869
CAS	13329-40-3
Molecular Weight (g/mol)	246.05
MDL Number	MFCD00045320
SMILES	CC(=O)C1=CC=C(C=C1)I
Synonym	4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone
IUPAC Name	1-(4-iodophenyl)ethanone
InChI Key	JZJWCDQGIPQBAO-UHFFFAOYSA-N
Molecular Formula	C₈H₇IO

116

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2'-Chloro-6'-fluoroacetophenone, 97%, Thermo Scientific™

CAS: 87327-69-3 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD01631390 InChI Key: DNVGZKIRMBCQEQ-UHFFFAOYSA-N PubChem CID: 2773578 SMILES: CC(=O)C1=C(F)C=CC=C1Cl

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Specifications

PubChem CID	2773578
CAS	87327-69-3
Molecular Weight (g/mol)	172.58
MDL Number	MFCD01631390
SMILES	CC(=O)C1=C(F)C=CC=C1Cl
InChI Key	DNVGZKIRMBCQEQ-UHFFFAOYSA-N
Molecular Formula	C8H6ClFO

117

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7-Chloroisatin, 97%

CAS: 7477-63-6 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.575 MDL Number: MFCD00022796 InChI Key: MPLXQMMMGDYXIT-UHFFFAOYSA-N PubChem CID: 344135 IUPAC Name: 7-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Cl)NC(=O)C2=O

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Specifications

PubChem CID	344135
CAS	7477-63-6
Molecular Weight (g/mol)	181.575
MDL Number	MFCD00022796
SMILES	C1=CC2=C(C(=C1)Cl)NC(=O)C2=O
IUPAC Name	7-chloro-1H-indole-2,3-dione
InChI Key	MPLXQMMMGDYXIT-UHFFFAOYSA-N
Molecular Formula	C8H4ClNO2

118

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2-Bromoacetophenone, 98%

CAS: 70-11-1 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.047 MDL Number: MFCD00000195 InChI Key: LIGACIXOYTUXAW-UHFFFAOYSA-N Synonym: 2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo PubChem CID: 6259 ChEBI: CHEBI:51846 IUPAC Name: 2-bromo-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)CBr

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Specifications

PubChem CID	6259
CAS	70-11-1
Molecular Weight (g/mol)	199.047
ChEBI	CHEBI:51846
MDL Number	MFCD00000195
SMILES	C1=CC=C(C=C1)C(=O)CBr
Synonym	2-bromoacetophenone,phenacyl bromide,2-bromo-1-phenylethan-1-one,bromoacetophenone,ethanone, 2-bromo-1-phenyl,bromomethyl phenyl ketone,alpha-bromoacetophenone,stauffer 4644,omega-bromoacetophenone,acetophenone, 2-bromo
IUPAC Name	2-bromo-1-phenylethanone
InChI Key	LIGACIXOYTUXAW-UHFFFAOYSA-N
Molecular Formula	C8H7BrO

119

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Methyl 5-acetylsalicylate, 98%

CAS: 16475-90-4 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00040924 InChI Key: XLSMGNNWSRNTIQ-UHFFFAOYSA-N Synonym: methyl 5-acetylsalicylate,5-acetylsalicylic acid methyl ester,5-acetyl-2-hydroxybenzoic acid methyl ester,methyl 2-hydroxy-5-acetylbenzoate,benzoic acid, 5-acetyl-2-hydroxy-, methyl ester,5-acetyl methyl salicylate,methyl 5-acethylsalicylate,pubchem22504,methyl5-acetylsalicylate,methyl-5-acetylsalicylate PubChem CID: 85444 IUPAC Name: methyl 5-acetyl-2-hydroxybenzoate SMILES: CC(=O)C1=CC(=C(C=C1)O)C(=O)OC

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Specifications

PubChem CID	85444
CAS	16475-90-4
Molecular Weight (g/mol)	194.186
MDL Number	MFCD00040924
SMILES	CC(=O)C1=CC(=C(C=C1)O)C(=O)OC
Synonym	methyl 5-acetylsalicylate,5-acetylsalicylic acid methyl ester,5-acetyl-2-hydroxybenzoic acid methyl ester,methyl 2-hydroxy-5-acetylbenzoate,benzoic acid, 5-acetyl-2-hydroxy-, methyl ester,5-acetyl methyl salicylate,methyl 5-acethylsalicylate,pubchem22504,methyl5-acetylsalicylate,methyl-5-acetylsalicylate
IUPAC Name	methyl 5-acetyl-2-hydroxybenzoate
InChI Key	XLSMGNNWSRNTIQ-UHFFFAOYSA-N
Molecular Formula	C10H10O4

120

1-(5-Fluoro-2-hydroxyphenyl)ethan-1-one, 97%, Thermo Scientific™

CAS: 394-32-1 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 InChI Key: KOFFXZYMDLWRHX-UHFFFAOYSA-N Synonym: 5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone PubChem CID: 95992 IUPAC Name: 1-(5-fluoro-2-hydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)F)O

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Specifications

PubChem CID	95992
CAS	394-32-1
Molecular Weight (g/mol)	154.14
SMILES	CC(=O)C1=C(C=CC(=C1)F)O
Synonym	5'-fluoro-2'-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl ethanone,1-5-fluoro-2-hydroxyphenyl ethan-1-one,5-fluoro-2-hydroxyacetophenone,1-5-fluoro-2-hydroxyphenyl-1-ethanone,2-hydroxy-5-fluoroacetophenone,2'-hydroxy-5'-fluoroacetophenone,ethanone, 1-5-fluoro-2-hydroxyphenyl,5'-fluoro-2'-hydroxy acetophenone,5'-fluoro-2'-hydroxy-acetophenone
IUPAC Name	1-(5-fluoro-2-hydroxyphenyl)ethanone
InChI Key	KOFFXZYMDLWRHX-UHFFFAOYSA-N
Molecular Formula	C8H7FO2

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