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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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1 – 15 of 45 results
1

3-Chloro-2,4-pentanedione, 98%

CAS: 1694-29-7 Molecular Formula: C5H7ClO2 Molecular Weight (g/mol): 134.56 MDL Number: MFCD00009651 InChI Key: VLRGXXKFHVJQOL-UHFFFAOYSA-N PubChem CID: 74328 IUPAC Name: 3-chloropentane-2,4-dione SMILES: CC(=O)C(C(=O)C)Cl

PubChem CID 74328
CAS 1694-29-7
Molecular Weight (g/mol) 134.56
MDL Number MFCD00009651
SMILES CC(=O)C(C(=O)C)Cl
IUPAC Name 3-chloropentane-2,4-dione
InChI Key VLRGXXKFHVJQOL-UHFFFAOYSA-N
Molecular Formula C5H7ClO2
2

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

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
3

2-Benzoylpyridine, 99+%

CAS: 91-02-1 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00006300 InChI Key: GCSHUYKULREZSJ-UHFFFAOYSA-N Synonym: 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone PubChem CID: 7038 IUPAC Name: phenyl(pyridin-2-yl)methanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=N2

PubChem CID 7038
CAS 91-02-1
Molecular Weight (g/mol) 183.21
MDL Number MFCD00006300
SMILES C1=CC=C(C=C1)C(=O)C2=CC=CC=N2
Synonym 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone
IUPAC Name phenyl(pyridin-2-yl)methanone
InChI Key GCSHUYKULREZSJ-UHFFFAOYSA-N
Molecular Formula C12H9NO
4

2-Acetylpyrrole, 99%

CAS: 1072-83-9 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.13 MDL Number: MFCD00005220 InChI Key: IGJQUJNPMOYEJY-UHFFFAOYSA-N Synonym: 2-acetylpyrrole,1-1h-pyrrol-2-yl ethanone,1-1h-pyrrol-2-yl ethan-1-one,2-acetyl pyrrole,2-pyrrolylethanone,2-acetyl-1h-pyrrole,methyl pyrrol-2-yl ketone,ethanone, 1-1h-pyrrol-2-yl,2-pyrrolyl methyl ketone,ketone, methyl pyrrol-2-yl PubChem CID: 14079 ChEBI: CHEBI:59981 IUPAC Name: 1-(1H-pyrrol-2-yl)ethanone SMILES: CC(=O)C1=CC=CN1

PubChem CID 14079
CAS 1072-83-9
Molecular Weight (g/mol) 109.13
ChEBI CHEBI:59981
MDL Number MFCD00005220
SMILES CC(=O)C1=CC=CN1
Synonym 2-acetylpyrrole,1-1h-pyrrol-2-yl ethanone,1-1h-pyrrol-2-yl ethan-1-one,2-acetyl pyrrole,2-pyrrolylethanone,2-acetyl-1h-pyrrole,methyl pyrrol-2-yl ketone,ethanone, 1-1h-pyrrol-2-yl,2-pyrrolyl methyl ketone,ketone, methyl pyrrol-2-yl
IUPAC Name 1-(1H-pyrrol-2-yl)ethanone
InChI Key IGJQUJNPMOYEJY-UHFFFAOYSA-N
Molecular Formula C6H7NO
5

2'-Iodoacetophenone, 99+%, Thermo Scientific Chemicals

CAS: 2142-70-3 Molecular Formula: C8H7IO Molecular Weight (g/mol): 246.04 MDL Number: MFCD00094998 InChI Key: XDXCBCXNCQGZPG-UHFFFAOYSA-N Synonym: 2'-iodoacetophenone,1-2-iodophenyl ethanone,o-iodoacetophenone,1-2-iodophenyl ethan-1-one,o-iodobenzoyl,acetophenone, o-iodo,acetophenone, 2'-iodo,ethanone, 1-iodophenyl,ethanone, 1-2-iodophenyl,1-acetyl-2-iodobenzene PubChem CID: 240431 IUPAC Name: 1-(2-iodophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1I

PubChem CID 240431
CAS 2142-70-3
Molecular Weight (g/mol) 246.04
MDL Number MFCD00094998
SMILES CC(=O)C1=CC=CC=C1I
Synonym 2'-iodoacetophenone,1-2-iodophenyl ethanone,o-iodoacetophenone,1-2-iodophenyl ethan-1-one,o-iodobenzoyl,acetophenone, o-iodo,acetophenone, 2'-iodo,ethanone, 1-iodophenyl,ethanone, 1-2-iodophenyl,1-acetyl-2-iodobenzene
IUPAC Name 1-(2-iodophenyl)ethanone
InChI Key XDXCBCXNCQGZPG-UHFFFAOYSA-N
Molecular Formula C8H7IO
6

Methyl 2-chloroacetoacetate, 95%

CAS: 4755-81-1 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00008757 InChI Key: GYQRIAVRKLRQKP-UHFFFAOYSA-N Synonym: methyl 2-chloroacetoacetate,butanoic acid, 2-chloro-3-oxo-, methyl ester,2-chloroacetoacetic acid methyl ester,2-chloro-3-oxo-butyric acid methyl ester,methyl2-chloroacetoacetate,acmc-209k9v,methyl-2-chloroacetoacetate,methyl-alpha-chloroacetoacetate,2-chloroacetoacetate methyl ester,gyqriavrklrqkp-uhfffaoysa PubChem CID: 107332 IUPAC Name: methyl 2-chloro-3-oxobutanoate SMILES: CC(=O)C(C(=O)OC)Cl

PubChem CID 107332
CAS 4755-81-1
Molecular Weight (g/mol) 150.56
MDL Number MFCD00008757
SMILES CC(=O)C(C(=O)OC)Cl
Synonym methyl 2-chloroacetoacetate,butanoic acid, 2-chloro-3-oxo-, methyl ester,2-chloroacetoacetic acid methyl ester,2-chloro-3-oxo-butyric acid methyl ester,methyl2-chloroacetoacetate,acmc-209k9v,methyl-2-chloroacetoacetate,methyl-alpha-chloroacetoacetate,2-chloroacetoacetate methyl ester,gyqriavrklrqkp-uhfffaoysa
IUPAC Name methyl 2-chloro-3-oxobutanoate
InChI Key GYQRIAVRKLRQKP-UHFFFAOYSA-N
Molecular Formula C5H7ClO3
7

2-Bromo-4'-methoxyacetophenone, 98%

CAS: 2632-13-5 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00000201 InChI Key: XQJAHBHCLXUGEP-UHFFFAOYSA-N Synonym: 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone PubChem CID: 4965 IUPAC Name: 2-bromo-1-(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)C(=O)CBr

PubChem CID 4965
CAS 2632-13-5
Molecular Weight (g/mol) 229.07
MDL Number MFCD00000201
SMILES COC1=CC=C(C=C1)C(=O)CBr
Synonym 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone
IUPAC Name 2-bromo-1-(4-methoxyphenyl)ethanone
InChI Key XQJAHBHCLXUGEP-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
8

2',4'-Dihydroxyacetophenone, 98%

CAS: 89-84-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002279 InChI Key: SULYEHHGGXARJS-UHFFFAOYSA-N Synonym: 2',4'-dihydroxyacetophenone,2,4-dihydroxyacetophenone,1-2,4-dihydroxyphenyl ethanone,resacetophenone,4-acetylresorcinol,resoacetophenone,ethanone, 1-2,4-dihydroxyphenyl,1-acetyl-2,4-dihydroxybenzene,resorcinol, 4-acetyl,1-2,4-dihydroxyphenyl ethan-1-one PubChem CID: 6990 ChEBI: CHEBI:18414 SMILES: CC(=O)C1=CC=C(O)C=C1O

PubChem CID 6990
CAS 89-84-9
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:18414
MDL Number MFCD00002279
SMILES CC(=O)C1=CC=C(O)C=C1O
Synonym 2',4'-dihydroxyacetophenone,2,4-dihydroxyacetophenone,1-2,4-dihydroxyphenyl ethanone,resacetophenone,4-acetylresorcinol,resoacetophenone,ethanone, 1-2,4-dihydroxyphenyl,1-acetyl-2,4-dihydroxybenzene,resorcinol, 4-acetyl,1-2,4-dihydroxyphenyl ethan-1-one
InChI Key SULYEHHGGXARJS-UHFFFAOYSA-N
Molecular Formula C8H8O3
9

2',4'-Difluoroacetophenone, 99%

CAS: 364-83-0 Molecular Formula: C8H6F2O Molecular Weight (g/mol): 156.12 MDL Number: MFCD00151261 InChI Key: QEWHNJPLPZOEKU-UHFFFAOYSA-N Synonym: 2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213 PubChem CID: 67770 IUPAC Name: 1-(2,4-difluorophenyl)ethanone SMILES: CC(=O)C1=C(C=C(C=C1)F)F

PubChem CID 67770
CAS 364-83-0
Molecular Weight (g/mol) 156.12
MDL Number MFCD00151261
SMILES CC(=O)C1=C(C=C(C=C1)F)F
Synonym 2',4'-difluoroacetophenone,1-2,4-difluorophenyl ethanone,2,4-difluoroacetophenone,1-2,4-difluorophenyl ethan-1-one,ethanone, 1-2,4-difluorophenyl,1-2,4-difluoro-phenyl-ethanone,1-acetyl-2,4-difluorobenzene,acetophenone, 2',4'-difluoro,1-2,4-difluorphenyl ethanon,pubchem4213
IUPAC Name 1-(2,4-difluorophenyl)ethanone
InChI Key QEWHNJPLPZOEKU-UHFFFAOYSA-N
Molecular Formula C8H6F2O
10

Benzoylnitromethane, 98%

CAS: 614-21-1 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.15 MDL Number: MFCD00010218 InChI Key: JTWHVBNYYWFXSI-UHFFFAOYSA-N Synonym: benzoylnitromethane,ethanone, 2-nitro-1-phenyl,alpha-nitroacetophenone,2-nitro-1-phenylethanon,nitroacetophenone,alpha-nitro acetophenone,acmc-1bdpo,acetophenone, 2-nitro,nitromethyl phenyl ketone,.alpha.-nitroacetophenone PubChem CID: 94833 IUPAC Name: 2-nitro-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C[N+](=O)[O-]

PubChem CID 94833
CAS 614-21-1
Molecular Weight (g/mol) 165.15
MDL Number MFCD00010218
SMILES C1=CC=C(C=C1)C(=O)C[N+](=O)[O-]
Synonym benzoylnitromethane,ethanone, 2-nitro-1-phenyl,alpha-nitroacetophenone,2-nitro-1-phenylethanon,nitroacetophenone,alpha-nitro acetophenone,acmc-1bdpo,acetophenone, 2-nitro,nitromethyl phenyl ketone,.alpha.-nitroacetophenone
IUPAC Name 2-nitro-1-phenylethanone
InChI Key JTWHVBNYYWFXSI-UHFFFAOYSA-N
Molecular Formula C8H7NO3
11

Thermo Scientific Chemicals D(-)-Fructose, 99%

CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.16 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300 PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

EDGE
PubChem CID 5984
CAS 57-48-7
Molecular Weight (g/mol) 180.16
ChEBI CHEBI:48095
SMILES C(C(C(C(C(=O)CO)O)O)O)O
Synonym d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300
IUPAC Name (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key BJHIKXHVCXFQLS-UYFOZJQFSA-N
Molecular Formula C6H12O6
12

Thermo Scientific Chemicals D(-)-Tagatose, 99+%

CAS: 87-81-0 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00134449 InChI Key: BJHIKXHVCXFQLS-PQLUHFTBSA-N Synonym: 3s,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,lyxo-2-hexulose,tagatose, d,d--tagatose,keto-d-tagatose,tagatose nf,unii-t7a20y888y,d-lyxo-hex-2-ulose,naturlose PubChem CID: 92092 ChEBI: CHEBI:47693 IUPAC Name: (3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

PubChem CID 92092
CAS 87-81-0
Molecular Weight (g/mol) 180.156
ChEBI CHEBI:47693
MDL Number MFCD00134449
SMILES C(C(C(C(C(=O)CO)O)O)O)O
Synonym 3s,4s,5r-1,3,4,5,6-pentahydroxyhexan-2-one,lyxo-2-hexulose,tagatose, d,d--tagatose,keto-d-tagatose,tagatose nf,unii-t7a20y888y,d-lyxo-hex-2-ulose,naturlose
IUPAC Name (3S,4S,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key BJHIKXHVCXFQLS-PQLUHFTBSA-N
Molecular Formula C6H12O6
13

Octanophenone, 98%

CAS: 1674-37-9 Molecular Formula: C14H20O Molecular Weight (g/mol): 204.31 MDL Number: MFCD00003554 InChI Key: UDEVCZRUNOLVLU-UHFFFAOYSA-N Synonym: octanophenone,heptyl phenyl ketone,1-octanone, 1-phenyl,caprylophenone,n-octanophenone,ketone, heptyl phenyl,4-n-butylbutyrophenone,1-phenyl-octan-1-one,acmc-1axlq PubChem CID: 74291 IUPAC Name: 1-phenyloctan-1-one SMILES: CCCCCCCC(=O)C1=CC=CC=C1

PubChem CID 74291
CAS 1674-37-9
Molecular Weight (g/mol) 204.31
MDL Number MFCD00003554
SMILES CCCCCCCC(=O)C1=CC=CC=C1
Synonym octanophenone,heptyl phenyl ketone,1-octanone, 1-phenyl,caprylophenone,n-octanophenone,ketone, heptyl phenyl,4-n-butylbutyrophenone,1-phenyl-octan-1-one,acmc-1axlq
IUPAC Name 1-phenyloctan-1-one
InChI Key UDEVCZRUNOLVLU-UHFFFAOYSA-N
Molecular Formula C14H20O
14

2-Bromo-4'-methoxyacetophenone, 98%

CAS: 2632-13-5 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00000201 InChI Key: XQJAHBHCLXUGEP-UHFFFAOYSA-N Synonym: 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone PubChem CID: 4965 IUPAC Name: 2-bromo-1-(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)C(=O)CBr

PubChem CID 4965
CAS 2632-13-5
Molecular Weight (g/mol) 229.07
MDL Number MFCD00000201
SMILES COC1=CC=C(C=C1)C(=O)CBr
Synonym 2-bromo-4'-methoxyacetophenone,2-bromo-1-4-methoxyphenyl ethanone,ethanone, 2-bromo-1-4-methoxyphenyl,p-methoxyphenacyl bromide,4'-methoxyphenacyl bromide,2-bromo-1-4-methoxyphenyl ethan-1-one,4-methoxyphenacyl bromide,bromomethyl 4-methoxyphenyl ketone,alpha-bromo-4-methoxyacetophenone,2-bromo-4-methoxyacetophenone
IUPAC Name 2-bromo-1-(4-methoxyphenyl)ethanone
InChI Key XQJAHBHCLXUGEP-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
15

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

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