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 1,257 results

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2',4'-Difluoro-2-(1H-1,2,4-triazol-1-yl)acetophenone, 97%

CAS: 86404-63-9 Molecular Formula: C10H7F2N3O Molecular Weight (g/mol): 223.183 MDL Number: MFCD02093825 InChI Key: XCHRPVARHBCFMJ-UHFFFAOYSA-N Synonym: 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethanone,2,4-difluoro-alpha-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1,2,4-triazol-1-yl ethanone,2',4'-difluoro-2-1h-1,2,4-triazol-1-yl acetophenone,unii-hxi8r9r915,2-1h-1,2,4-triazol-1-yl-2',4'-difluoroacetophenone,ethanone, 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl,2',4'-difluoro-2-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethan-1-one,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl-ethanone PubChem CID: 588080 IUPAC Name: 1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone SMILES: C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2

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Specifications

PubChem CID	588080
CAS	86404-63-9
Molecular Weight (g/mol)	223.183
MDL Number	MFCD02093825
SMILES	C1=CC(=C(C=C1F)F)C(=O)CN2C=NC=N2
Synonym	1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethanone,2,4-difluoro-alpha-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1,2,4-triazol-1-yl ethanone,2',4'-difluoro-2-1h-1,2,4-triazol-1-yl acetophenone,unii-hxi8r9r915,2-1h-1,2,4-triazol-1-yl-2',4'-difluoroacetophenone,ethanone, 1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl,2',4'-difluoro-2-1h-1,2,4-triazolyl acetophenone,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl ethan-1-one,1-2,4-difluorophenyl-2-1h-1,2,4-triazol-1-yl-ethanone
IUPAC Name	1-(2,4-difluorophenyl)-2-(1,2,4-triazol-1-yl)ethanone
InChI Key	XCHRPVARHBCFMJ-UHFFFAOYSA-N
Molecular Formula	C10H7F2N3O

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4'-Acetamidoacetophenone, 98%

CAS: 2719-21-3 Molecular Formula: C10H11NO2 Molecular Weight (g/mol): 177.203 MDL Number: MFCD00014965 InChI Key: WECHHDJTILFYQT-UHFFFAOYSA-N Synonym: 4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone PubChem CID: 75937 IUPAC Name: N-(4-acetylphenyl)acetamide SMILES: CC(=O)C1=CC=C(C=C1)NC(=O)C

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Specifications

PubChem CID	75937
CAS	2719-21-3
Molecular Weight (g/mol)	177.203
MDL Number	MFCD00014965
SMILES	CC(=O)C1=CC=C(C=C1)NC(=O)C
Synonym	4'-acetamidoacetophenone,n-4-acetylphenyl acetamide,4-acetamidoacetophenone,n-p-acetylphenyl acetamide,acetamide, n-4-acetylphenyl,p-acetylaminoacetophenone,4-acetylacetanilide,4'-acetylacetanilide,p-acetamidoacetophenone,4-acetamido-acetophenone
IUPAC Name	N-(4-acetylphenyl)acetamide
InChI Key	WECHHDJTILFYQT-UHFFFAOYSA-N
Molecular Formula	C10H11NO2

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1,1,1,3,3,3-Hexafluoroacetone sesquihydrate, 98%

CAS: 13098-39-0 Molecular Formula: ₁·5 H₂O Molecular Weight (g/mol): 193.05 MDL Number: MFCD06800792 InChI Key: VAIZVCMDJPBJCM-UHFFFAOYSA-N Synonym: hexafluoroacetone sesquihydrate,unii-cu1noz8ps6,ccris 4653,acetone, hexafluoro-, sesquihydrate,hexafluoro-2-propanone sesquihydrate,cu1noz8ps6,2-propanone, hexafluoro-, sesquihydrate,1,1,1,3,3,3-hexafluoroacetone sesquihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, hydrate 2:3,hexafluoroacetone 1.5-hydrate PubChem CID: 3032602 IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate SMILES: C(=O)(C(F)(F)F)C(F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F.O.O.O

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Specifications

PubChem CID	3032602
CAS	13098-39-0
Molecular Weight (g/mol)	193.05
MDL Number	MFCD06800792
SMILES	C(=O)(C(F)(F)F)C(F)(F)F.C(=O)(C(F)(F)F)C(F)(F)F.O.O.O
Synonym	hexafluoroacetone sesquihydrate,unii-cu1noz8ps6,ccris 4653,acetone, hexafluoro-, sesquihydrate,hexafluoro-2-propanone sesquihydrate,cu1noz8ps6,2-propanone, hexafluoro-, sesquihydrate,1,1,1,3,3,3-hexafluoroacetone sesquihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, hydrate 2:3,hexafluoroacetone 1.5-hydrate
IUPAC Name	1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate
InChI Key	VAIZVCMDJPBJCM-UHFFFAOYSA-N
Molecular Formula	₁·5 H₂O

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2,3'-Dibromoacetophenone, 97%

CAS: 18523-22-3 Molecular Formula: C8H6Br2O Molecular Weight (g/mol): 277.943 MDL Number: MFCD00082698 InChI Key: MZBXSQBQPJWECM-UHFFFAOYSA-N Synonym: 3-bromophenacyl bromide,2,3'-dibromoacetophenone,2-bromo-1-3-bromophenyl ethanone,ethanone, 2-bromo-1-3-bromophenyl,2-bromo-1-3-bromophenyl ethan-1-one,3-bromophenacylbromide,2-bromo-1-3-bromo-phenyl-ethanone,2-bromo-3'-bromoacetophenone,2-bromo-1-3-bromophenyl-1-ethanone PubChem CID: 519585 IUPAC Name: 2-bromo-1-(3-bromophenyl)ethanone SMILES: C1=CC(=CC(=C1)Br)C(=O)CBr

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Specifications

PubChem CID	519585
CAS	18523-22-3
Molecular Weight (g/mol)	277.943
MDL Number	MFCD00082698
SMILES	C1=CC(=CC(=C1)Br)C(=O)CBr
Synonym	3-bromophenacyl bromide,2,3'-dibromoacetophenone,2-bromo-1-3-bromophenyl ethanone,ethanone, 2-bromo-1-3-bromophenyl,2-bromo-1-3-bromophenyl ethan-1-one,3-bromophenacylbromide,2-bromo-1-3-bromo-phenyl-ethanone,2-bromo-3'-bromoacetophenone,2-bromo-1-3-bromophenyl-1-ethanone
IUPAC Name	2-bromo-1-(3-bromophenyl)ethanone
InChI Key	MZBXSQBQPJWECM-UHFFFAOYSA-N
Molecular Formula	C8H6Br2O

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3-Benzoylpropionic acid, 98+%

CAS: 2051-95-8 Molecular Formula: C10H10O3 Molecular Weight (g/mol): 178.19 MDL Number: MFCD00002792 InChI Key: KMQLIDDEQAJAGJ-UHFFFAOYSA-N Synonym: 3-benzoylpropionic acid,4-oxo-4-phenylbutyric acid,3-benzoylpropanoic acid,beta-benzoylpropionic acid,benzoylpropionic acid,propanoic acid, 3-benzoyl,benzenebutanoic acid, .gamma.-oxo,3-benzoylpropionicacid,propionic acid, 3-benzoyl,4-phenyl-4-oxobutyric acid PubChem CID: 72871 ChEBI: CHEBI:64437 IUPAC Name: 4-oxo-4-phenylbutanoic acid SMILES: OC(=O)CCC(=O)C1=CC=CC=C1

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Specifications

PubChem CID	72871
CAS	2051-95-8
Molecular Weight (g/mol)	178.19
ChEBI	CHEBI:64437
MDL Number	MFCD00002792
SMILES	OC(=O)CCC(=O)C1=CC=CC=C1
Synonym	3-benzoylpropionic acid,4-oxo-4-phenylbutyric acid,3-benzoylpropanoic acid,beta-benzoylpropionic acid,benzoylpropionic acid,propanoic acid, 3-benzoyl,benzenebutanoic acid, .gamma.-oxo,3-benzoylpropionicacid,propionic acid, 3-benzoyl,4-phenyl-4-oxobutyric acid
IUPAC Name	4-oxo-4-phenylbutanoic acid
InChI Key	KMQLIDDEQAJAGJ-UHFFFAOYSA-N
Molecular Formula	C10H10O3

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4'-Bromo-4-chlorobutyrophenone, 98%

CAS: 4559-96-0 Molecular Formula: C10H10BrClO Molecular Weight (g/mol): 261.54 MDL Number: MFCD00001006 InChI Key: WJKPUMBLABGUCQ-UHFFFAOYSA-N Synonym: 1-4-bromophenyl-4-chlorobutan-1-one,4'-bromo-4-chlorobutyrophenone,1-4-bromophenyl-4-chloro-1-butanone,1-butanone, 1-4-bromophenyl-4-chloro,acmc-20amn1,4-chloro-p-bromobutyrophenone,4-chloro-4'-bromobutyrophenone,4-bromo-4-chlorobutyrophenone,4/'-bromo-4-chlorobutyrophenone,4'-bromo-gamma-chlorobutyrophenone PubChem CID: 78317 IUPAC Name: 1-(4-bromophenyl)-4-chlorobutan-1-one SMILES: ClCCCC(=O)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	78317
CAS	4559-96-0
Molecular Weight (g/mol)	261.54
MDL Number	MFCD00001006
SMILES	ClCCCC(=O)C1=CC=C(Br)C=C1
Synonym	1-4-bromophenyl-4-chlorobutan-1-one,4'-bromo-4-chlorobutyrophenone,1-4-bromophenyl-4-chloro-1-butanone,1-butanone, 1-4-bromophenyl-4-chloro,acmc-20amn1,4-chloro-p-bromobutyrophenone,4-chloro-4'-bromobutyrophenone,4-bromo-4-chlorobutyrophenone,4/'-bromo-4-chlorobutyrophenone,4'-bromo-gamma-chlorobutyrophenone
IUPAC Name	1-(4-bromophenyl)-4-chlorobutan-1-one
InChI Key	WJKPUMBLABGUCQ-UHFFFAOYSA-N
Molecular Formula	C10H10BrClO

Glycerin Base TS, Ricca Chemical

CAS: 7732-18-5 Synonym: dihydrogen oxide,dihydrogen monoxide

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Specifications

CAS	7732-18-5
Synonym	dihydrogen oxide,dihydrogen monoxide

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Thermo Scientific Chemicals D-Fructose, 99%

CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00148910 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

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Specifications

PubChem CID	5984
CAS	57-48-7
Molecular Weight (g/mol)	180.156
ChEBI	CHEBI:48095
MDL Number	MFCD00148910
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

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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

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Specifications

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

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4-Acetylbiphenyl, 98%

CAS: 92-91-1 Molecular Formula: C14H12O Molecular Weight (g/mol): 196.249 MDL Number: MFCD00008749 InChI Key: QCZZSANNLWPGEA-UHFFFAOYSA-N Synonym: 4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl PubChem CID: 7113 IUPAC Name: 1-(4-phenylphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2

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Specifications

PubChem CID	7113
CAS	92-91-1
Molecular Weight (g/mol)	196.249
MDL Number	MFCD00008749
SMILES	CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2
Synonym	4-acetylbiphenyl,4'-phenylacetophenone,4-phenylacetophenone,4-biphenylyl methyl ketone,p-phenylacetophenone,p-acetylbiphenyl,1-1,1'-biphenyl-4-yl ethanone,acetophenone, 4'-phenyl,1-4-phenylphenyl ethanone,ketone, 4-biphenylyl methyl
IUPAC Name	1-(4-phenylphenyl)ethanone
InChI Key	QCZZSANNLWPGEA-UHFFFAOYSA-N
Molecular Formula	C14H12O

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3-(4-Methoxybenzoyl)propionic acid, 98+%

CAS: 3153-44-4 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD00002795 InChI Key: OMTDIBZSUZNVJK-UHFFFAOYSA-N Synonym: 3-4-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxobutanoic acid,4-4-methoxyphenyl-4-oxobutyric acid,3-4-methoxybenzoyl propanoic acid,beta-p-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxo-butyric acid,4-4-methoxyphenyl-4-oxo-butanoic acid,benzenebutanoic acid, 4-methoxy-gamma-oxo,maybridge1_002003,acmc-1cl1u PubChem CID: 76613 IUPAC Name: 4-(4-methoxyphenyl)-4-oxobutanoic acid SMILES: COC1=CC=C(C=C1)C(=O)CCC(=O)O

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Specifications

PubChem CID	76613
CAS	3153-44-4
Molecular Weight (g/mol)	208.213
MDL Number	MFCD00002795
SMILES	COC1=CC=C(C=C1)C(=O)CCC(=O)O
Synonym	3-4-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxobutanoic acid,4-4-methoxyphenyl-4-oxobutyric acid,3-4-methoxybenzoyl propanoic acid,beta-p-methoxybenzoyl propionic acid,4-4-methoxyphenyl-4-oxo-butyric acid,4-4-methoxyphenyl-4-oxo-butanoic acid,benzenebutanoic acid, 4-methoxy-gamma-oxo,maybridge1_002003,acmc-1cl1u
IUPAC Name	4-(4-methoxyphenyl)-4-oxobutanoic acid
InChI Key	OMTDIBZSUZNVJK-UHFFFAOYSA-N
Molecular Formula	C11H12O4

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2,2,2,3'-Tetrafluoroacetophenone, 98%

CAS: 708-64-5 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.11 MDL Number: MFCD00039236 InChI Key: NQSPTMFCJGKOQJ-UHFFFAOYSA-N Synonym: 2,2,2,3'-tetrafluoroacetophenone,2,2,2-trifluoro-1-3-fluorophenyl ethanone,m-fluorotrifluoroacetophenone,acetophenone, 2,2,2,3'-tetrafluoro,2,2,2-trifluoro-1-3-fluorophenyl ethan-1-one,ethanone, 2,2,2-trifluoro-1-3-fluorophenyl,ethanone,2,2,2-trifluoro-1-3-fluorophenyl,acmc-20aol4,m,alpha,alpha,alpha-tetrafluoroacetophenone,2,2,2,3'-trtrafluoroacetophenone PubChem CID: 69723 IUPAC Name: 2,2,2-trifluoro-1-(3-fluorophenyl)ethanone SMILES: FC1=CC=CC(=C1)C(=O)C(F)(F)F

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Specifications

PubChem CID	69723
CAS	708-64-5
Molecular Weight (g/mol)	192.11
MDL Number	MFCD00039236
SMILES	FC1=CC=CC(=C1)C(=O)C(F)(F)F
Synonym	2,2,2,3'-tetrafluoroacetophenone,2,2,2-trifluoro-1-3-fluorophenyl ethanone,m-fluorotrifluoroacetophenone,acetophenone, 2,2,2,3'-tetrafluoro,2,2,2-trifluoro-1-3-fluorophenyl ethan-1-one,ethanone, 2,2,2-trifluoro-1-3-fluorophenyl,ethanone,2,2,2-trifluoro-1-3-fluorophenyl,acmc-20aol4,m,alpha,alpha,alpha-tetrafluoroacetophenone,2,2,2,3'-trtrafluoroacetophenone
IUPAC Name	2,2,2-trifluoro-1-(3-fluorophenyl)ethanone
InChI Key	NQSPTMFCJGKOQJ-UHFFFAOYSA-N
Molecular Formula	C8H4F4O

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Methyl 3-trifluoromethylbenzoylacetate, 95%, Thermo Scientific™

CAS: 93618-66-7 Molecular Formula: C11H9F3O3 Molecular Weight (g/mol): 246.19 MDL Number: MFCD00216522 InChI Key: RPRMYRPHNDGZOY-UHFFFAOYSA-N Synonym: methyl 3-oxo-3-3-trifluoromethyl phenyl propanoate,methyl 3-trifluoromethyl benzoylacetate,methyl 3-trifluoromethyl benzoyl acetate,3-3-trifluoromethylphenyl-3-oxo-propionic acid methyl ester,3-oxo-3-3-trifluoromethyl-phenyl-propionic acid methyl ester,pubchem2695,methyl 3-trifluoromethylbenzoylacetate,methyl 3-oxo-3-3-trifluoromethylphenyl propanoate,3-oxo-3-3-trifluoromethylphenyl propionic acid methyl ester PubChem CID: 735880 IUPAC Name: methyl 3-oxo-3-[3-(trifluoromethyl)phenyl]propanoate SMILES: COC(=O)CC(=O)C1=CC=CC(=C1)C(F)(F)F

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Specifications

PubChem CID	735880
CAS	93618-66-7
Molecular Weight (g/mol)	246.19
MDL Number	MFCD00216522
SMILES	COC(=O)CC(=O)C1=CC=CC(=C1)C(F)(F)F
Synonym	methyl 3-oxo-3-3-trifluoromethyl phenyl propanoate,methyl 3-trifluoromethyl benzoylacetate,methyl 3-trifluoromethyl benzoyl acetate,3-3-trifluoromethylphenyl-3-oxo-propionic acid methyl ester,3-oxo-3-3-trifluoromethyl-phenyl-propionic acid methyl ester,pubchem2695,methyl 3-trifluoromethylbenzoylacetate,methyl 3-oxo-3-3-trifluoromethylphenyl propanoate,3-oxo-3-3-trifluoromethylphenyl propionic acid methyl ester
IUPAC Name	methyl 3-oxo-3-[3-(trifluoromethyl)phenyl]propanoate
InChI Key	RPRMYRPHNDGZOY-UHFFFAOYSA-N
Molecular Formula	C11H9F3O3

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Ethyl isonicotinoylacetate, 95%

CAS: 26377-17-3 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00094021 InChI Key: PCJNYGPKMQQCPX-UHFFFAOYSA-N Synonym: ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester PubChem CID: 2735202 IUPAC Name: ethyl 3-oxo-3-pyridin-4-ylpropanoate SMILES: CCOC(=O)CC(=O)C1=CC=NC=C1

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Specifications

PubChem CID	2735202
CAS	26377-17-3
Molecular Weight (g/mol)	193.20
MDL Number	MFCD00094021
SMILES	CCOC(=O)CC(=O)C1=CC=NC=C1
Synonym	ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester
IUPAC Name	ethyl 3-oxo-3-pyridin-4-ylpropanoate
InChI Key	PCJNYGPKMQQCPX-UHFFFAOYSA-N
Molecular Formula	C10H11NO3

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Methyl nicotinoylacetate, 95%

CAS: 54950-20-8 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.18 MDL Number: MFCD00216524 InChI Key: JUQKVXRLRKKRPL-UHFFFAOYSA-N Synonym: methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate PubChem CID: 108645 IUPAC Name: methyl 3-oxo-3-pyridin-3-ylpropanoate SMILES: COC(=O)CC(=O)C1=CC=CN=C1

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Specifications

PubChem CID	108645
CAS	54950-20-8
Molecular Weight (g/mol)	179.18
MDL Number	MFCD00216524
SMILES	COC(=O)CC(=O)C1=CC=CN=C1
Synonym	methyl nicotinoylacetate,methyl 3-oxo-3-pyridin-3-yl propanoate,3-oxo-3-pyridin-3-ylpropionic acid methyl ester,3-pyridinepropanoic acid, .beta.-oxo-, methyl ester,methyl 3-oxo-3-3-pyridyl propanoate,methyl 3-pyridinecarbonyl acetate,methyl 2-nicotinoyl acetate,3-pyridinepropanoic acid, beta-oxo-, methyl ester,methyl-3-oxo-3 3-pyridinyl propanoate
IUPAC Name	methyl 3-oxo-3-pyridin-3-ylpropanoate
InChI Key	JUQKVXRLRKKRPL-UHFFFAOYSA-N
Molecular Formula	C9H9NO3

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