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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 23 results
1

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
2

1,4-Dihydroxyanthraquinone, 95%

CAS: 81-64-1 Molecular Formula: C14H8O4 Molecular Weight (g/mol): 240.214 MDL Number: MFCD00001209 InChI Key: GUEIZVNYDFNHJU-UHFFFAOYSA-N Synonym: quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy PubChem CID: 6688 ChEBI: CHEBI:37487 IUPAC Name: 1,4-dihydroxyanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O

PubChem CID 6688
CAS 81-64-1
Molecular Weight (g/mol) 240.214
ChEBI CHEBI:37487
MDL Number MFCD00001209
SMILES C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)O)O
Synonym quinizarin,1,4-dihydroxyanthraquinone,quinizarine,chinizarin,solvent orange 86,1,4-dihydroxyanthrachinon,smoke orange r,1,4-dihydroxy-9,10-anthraquinone,macrolex orange gg,9,10-anthracenedione, 1,4-dihydroxy
IUPAC Name 1,4-dihydroxyanthracene-9,10-dione
InChI Key GUEIZVNYDFNHJU-UHFFFAOYSA-N
Molecular Formula C14H8O4
3

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
4

4,5-Diazafluoren-9-one, 98%

CAS: 50890-67-0 Molecular Formula: C11H6N2O Molecular Weight (g/mol): 182.182 MDL Number: MFCD00046892 InChI Key: PFMTUGNLBQSHQC-UHFFFAOYSA-N Synonym: 4,5-diazafluoren-9-one,5h-cyclopenta 1,2-b:5,4-b' dipyridin-5-one,5h-cyclopenta 2,1-b:3,4-b' dipyridin-5-one,5h-pyrido 3',2':4,5 cyclopenta 1,2-b pyridin-5-one,pyridino 3',2'-1,2 cyclopenta 3,4-b pyridin-5-one,dafone,dafo,4,5-diazafluorenone-0,4,5-diaza-9h-fluoren-9-one PubChem CID: 342157 SMILES: C1=CC2=C(C3=C(C2=O)C=CC=N3)N=C1

PubChem CID 342157
CAS 50890-67-0
Molecular Weight (g/mol) 182.182
MDL Number MFCD00046892
SMILES C1=CC2=C(C3=C(C2=O)C=CC=N3)N=C1
Synonym 4,5-diazafluoren-9-one,5h-cyclopenta 1,2-b:5,4-b' dipyridin-5-one,5h-cyclopenta 2,1-b:3,4-b' dipyridin-5-one,5h-pyrido 3',2':4,5 cyclopenta 1,2-b pyridin-5-one,pyridino 3',2'-1,2 cyclopenta 3,4-b pyridin-5-one,dafone,dafo,4,5-diazafluorenone-0,4,5-diaza-9h-fluoren-9-one
InChI Key PFMTUGNLBQSHQC-UHFFFAOYSA-N
Molecular Formula C11H6N2O
5

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
6

Ethyl 4-chloroacetoacetate, 97%

CAS: 638-07-3 Molecular Formula: C6H9ClO3 Molecular Weight (g/mol): 164.585 MDL Number: MFCD00000939 InChI Key: OHLRLMWUFVDREV-UHFFFAOYSA-N Synonym: ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate PubChem CID: 69484 IUPAC Name: ethyl 4-chloro-3-oxobutanoate SMILES: CCOC(=O)CC(=O)CCl

PubChem CID 69484
CAS 638-07-3
Molecular Weight (g/mol) 164.585
MDL Number MFCD00000939
SMILES CCOC(=O)CC(=O)CCl
Synonym ethyl 4-chloroacetoacetate,4-chloroacetoacetic acid ethyl ester,butanoic acid, 4-chloro-3-oxo-, ethyl ester,ethyl gamma-chloroacetoacetate,unii-5ae82250cm,ccris 6791,ethyl chloroacetyl acetate,butanoic acid, 4-chloro-3-oxo-ethylester,ethyl 4-chloro-3-oxobutyrate,ethyl 4-chloro-3-oxo-butanoate
IUPAC Name ethyl 4-chloro-3-oxobutanoate
InChI Key OHLRLMWUFVDREV-UHFFFAOYSA-N
Molecular Formula C6H9ClO3
7

1,1,1-Trifluoro-2,4-pentanedione, 98%

CAS: 367-57-7 Molecular Formula: C5H5F3O2 Molecular Weight (g/mol): 154.09 MDL Number: MFCD00000427 InChI Key: SHXHPUAKLCCLDV-UHFFFAOYSA-N Synonym: 1,1,1-trifluoro-2,4-pentanedione,trifluoroacetylacetone,1,1,1-trifluoroacetylacetone,trifluoroacetyl acetone,acetyl trifluoroacetone,2,4-pentanedione, 1,1,1-trifluoro,tfpd-h,unii-9n20a8g8sw,alpha,alpha,alpha-trifluoroacetylacetone,a,a,a-trifluoroacetylacetone PubChem CID: 73943 IUPAC Name: 1,1,1-trifluoropentane-2,4-dione SMILES: CC(=O)CC(=O)C(F)(F)F

PubChem CID 73943
CAS 367-57-7
Molecular Weight (g/mol) 154.09
MDL Number MFCD00000427
SMILES CC(=O)CC(=O)C(F)(F)F
Synonym 1,1,1-trifluoro-2,4-pentanedione,trifluoroacetylacetone,1,1,1-trifluoroacetylacetone,trifluoroacetyl acetone,acetyl trifluoroacetone,2,4-pentanedione, 1,1,1-trifluoro,tfpd-h,unii-9n20a8g8sw,alpha,alpha,alpha-trifluoroacetylacetone,a,a,a-trifluoroacetylacetone
IUPAC Name 1,1,1-trifluoropentane-2,4-dione
InChI Key SHXHPUAKLCCLDV-UHFFFAOYSA-N
Molecular Formula C5H5F3O2
8

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
9

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
10

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
11

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
12

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
13

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
14

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
15

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