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Carbonyl compounds

Organic compounds that contain one or more carbonyl (a carbon atom with a double bond to an oxygen atom) functional groups. Includes compounds with functional groups that contain a carbonyl in their structure such as ketones, aldehydes, and others.
Complex Ketones (4,326)
Complex Aldehydes (4,268)
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Alpha beta-unsaturated carbonyl compounds (547)
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1,381 – 1,395 of 6,893 results
1,381

2'-Bromoacetophenone, 99%

CAS: 2142-69-0 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.05 MDL Number: MFCD00000067 InChI Key: PIMNFNXBTGPCIL-UHFFFAOYSA-N Synonym: 2'-bromoacetophenone,1-2-bromophenyl ethanone,o-bromoacetophenone,ethanone, 1-2-bromophenyl,1-acetyl-2-bromobenzene,1-2-bromophenyl ethan-1-one,acetophenone, 2'-bromo,1-2-bromomphenyl ethanone,acetophenone, o-bromo,o-bromophenyl methyl ketone PubChem CID: 75060 IUPAC Name: 1-(2-bromophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1Br

PubChem CID 75060
CAS 2142-69-0
Molecular Weight (g/mol) 199.05
MDL Number MFCD00000067
SMILES CC(=O)C1=CC=CC=C1Br
Synonym 2'-bromoacetophenone,1-2-bromophenyl ethanone,o-bromoacetophenone,ethanone, 1-2-bromophenyl,1-acetyl-2-bromobenzene,1-2-bromophenyl ethan-1-one,acetophenone, 2'-bromo,1-2-bromomphenyl ethanone,acetophenone, o-bromo,o-bromophenyl methyl ketone
IUPAC Name 1-(2-bromophenyl)ethanone
InChI Key PIMNFNXBTGPCIL-UHFFFAOYSA-N
Molecular Formula C8H7BrO
1,382

3-Bromo-5-chloro-2-hydroxybenzaldehyde, 97%

CAS: 19652-32-5 Molecular Formula: C7H4BrClO2 Molecular Weight (g/mol): 235.461 MDL Number: MFCD00051690 InChI Key: KNOYZLVIXXBBIB-UHFFFAOYSA-N Synonym: 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa PubChem CID: 519676 IUPAC Name: 3-bromo-5-chloro-2-hydroxybenzaldehyde SMILES: C1=C(C=C(C(=C1Br)O)C=O)Cl

PubChem CID 519676
CAS 19652-32-5
Molecular Weight (g/mol) 235.461
MDL Number MFCD00051690
SMILES C1=C(C=C(C(=C1Br)O)C=O)Cl
Synonym 3-bromo-5-chlorosalicylaldehyde,3-bromo-5-chlorosalicylic aldehyde,benzaldehyde, 3-bromo-5-chloro-2-hydroxy,3-bromo-5-chloro salicyclic aldehyde,3-bromo-5-chloro-2-hydroxy-benzaldehyde,3-bromo-5-chloro-o-hydroxybenzaldehyde,pubchem3591,acmc-1bs9s,akos bb-6948,knoyzlvixxbbib-uhfffaoysa
IUPAC Name 3-bromo-5-chloro-2-hydroxybenzaldehyde
InChI Key KNOYZLVIXXBBIB-UHFFFAOYSA-N
Molecular Formula C7H4BrClO2
1,383

beta-Ionone, 96%

CAS: 79-77-6 Molecular Formula: C13H20O Molecular Weight (g/mol): 192.302 MDL Number: MFCD00001549 InChI Key: PSQYTAPXSHCGMF-BQYQJAHWSA-N Synonym: beta-ionone,trans-beta-ionone,e-beta-ionone,4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,.beta.-ionone,3e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,4-2,6,6-trimethyl-1-cyclohexenyl-3-buten-2-one,unii-a7nrr1hlh6,e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,beta-e-ionone PubChem CID: 638014 ChEBI: CHEBI:32325 IUPAC Name: (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one SMILES: CC1=C(C(CCC1)(C)C)C=CC(=O)C

PubChem CID 638014
CAS 79-77-6
Molecular Weight (g/mol) 192.302
ChEBI CHEBI:32325
MDL Number MFCD00001549
SMILES CC1=C(C(CCC1)(C)C)C=CC(=O)C
Synonym beta-ionone,trans-beta-ionone,e-beta-ionone,4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,.beta.-ionone,3e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,4-2,6,6-trimethyl-1-cyclohexenyl-3-buten-2-one,unii-a7nrr1hlh6,e-4-2,6,6-trimethylcyclohex-1-en-1-yl but-3-en-2-one,beta-e-ionone
IUPAC Name (E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-one
InChI Key PSQYTAPXSHCGMF-BQYQJAHWSA-N
Molecular Formula C13H20O
1,384

3-(4-Fluorobenzoyl)propionic acid, 97%

CAS: 366-77-8 Molecular Formula: C10H9FO3 Molecular Weight (g/mol): 196.177 MDL Number: MFCD00002793 InChI Key: WUYWHIAAQYQKPP-UHFFFAOYSA-N Synonym: 3-4-fluorobenzoyl propionic acid,4-4-fluorophenyl-4-oxobutanoic acid,3-4-fluorobenzoyl propanoic acid,haloperidol metabolite iii,unii-v2z6n6jc9z,beta-4-fluorobenzoyl propionic acid,v2z6n6jc9z,3-p-fluorobenzoyl propionic acid,4-4-fluoro-phenyl-4-oxo-butyric acid PubChem CID: 101359 IUPAC Name: 4-(4-fluorophenyl)-4-oxobutanoic acid SMILES: C1=CC(=CC=C1C(=O)CCC(=O)O)F

PubChem CID 101359
CAS 366-77-8
Molecular Weight (g/mol) 196.177
MDL Number MFCD00002793
SMILES C1=CC(=CC=C1C(=O)CCC(=O)O)F
Synonym 3-4-fluorobenzoyl propionic acid,4-4-fluorophenyl-4-oxobutanoic acid,3-4-fluorobenzoyl propanoic acid,haloperidol metabolite iii,unii-v2z6n6jc9z,beta-4-fluorobenzoyl propionic acid,v2z6n6jc9z,3-p-fluorobenzoyl propionic acid,4-4-fluoro-phenyl-4-oxo-butyric acid
IUPAC Name 4-(4-fluorophenyl)-4-oxobutanoic acid
InChI Key WUYWHIAAQYQKPP-UHFFFAOYSA-N
Molecular Formula C10H9FO3
1,385

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
1,386

3-Chlorobenzoylacetonitrile, 98%

CAS: 21667-62-9 Molecular Formula: C9H6ClNO Molecular Weight (g/mol): 179.60 MDL Number: MFCD00067891 InChI Key: IUDFNNHFARLIPF-UHFFFAOYSA-N Synonym: 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670 PubChem CID: 140855 IUPAC Name: 3-(3-chlorophenyl)-3-oxopropanenitrile SMILES: ClC1=CC=CC(=C1)C(=O)CC#N

PubChem CID 140855
CAS 21667-62-9
Molecular Weight (g/mol) 179.60
MDL Number MFCD00067891
SMILES ClC1=CC=CC(=C1)C(=O)CC#N
Synonym 3-chlorobenzoylacetonitrile,3-3-chlorophenyl-3-oxopropanenitrile,3-chlorophenacylcyanide,3-chlorobenzoyl acetonitrile,3-3-chlorophenyl-3-oxo-propanenitrile,beta-ketonitrile 5b,pubchem12046,m-chlorophenacyl cyanide,acmc-1cqmb,maybridge1_004670
IUPAC Name 3-(3-chlorophenyl)-3-oxopropanenitrile
InChI Key IUDFNNHFARLIPF-UHFFFAOYSA-N
Molecular Formula C9H6ClNO
1,387

Malonamide, 98%

CAS: 108-13-4 Molecular Formula: C3H6N2O2 Molecular Weight (g/mol): 102.093 MDL Number: MFCD00008034 InChI Key: WRIRWRKPLXCTFD-UHFFFAOYSA-N Synonym: malonamide,malonodiamide,malondiamide,malonyldiamide,carboxamidoacetamide,malonic acid diamide,malonic diamide,unii-qvq8cng255,qvq8cng255,methane-1,1-dicarboxamide PubChem CID: 7911 IUPAC Name: propanediamide SMILES: C(C(=O)N)C(=O)N

PubChem CID 7911
CAS 108-13-4
Molecular Weight (g/mol) 102.093
MDL Number MFCD00008034
SMILES C(C(=O)N)C(=O)N
Synonym malonamide,malonodiamide,malondiamide,malonyldiamide,carboxamidoacetamide,malonic acid diamide,malonic diamide,unii-qvq8cng255,qvq8cng255,methane-1,1-dicarboxamide
IUPAC Name propanediamide
InChI Key WRIRWRKPLXCTFD-UHFFFAOYSA-N
Molecular Formula C3H6N2O2
1,388

4'-Benzyloxyacetophenone, 98%

CAS: 54696-05-8 Molecular Formula: C15H14O2 Molecular Weight (g/mol): 226.275 MDL Number: MFCD00017247 InChI Key: MKYMYZJJFMPDOA-UHFFFAOYSA-N Synonym: 4'-benzyloxyacetophenone,1-4-benzyloxy phenyl ethanone,4-benzyloxyacetophenone,4'-benzyloxy-acetophenone,1-4-benzyloxy phenyl ethan-1-one,ethanone, 1-4-phenylmethoxy phenyl,4'-benzyloxy acetophenone,1-4-benzyloxyphenyl ethanone PubChem CID: 245226 IUPAC Name: 1-(4-phenylmethoxyphenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

PubChem CID 245226
CAS 54696-05-8
Molecular Weight (g/mol) 226.275
MDL Number MFCD00017247
SMILES CC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2
Synonym 4'-benzyloxyacetophenone,1-4-benzyloxy phenyl ethanone,4-benzyloxyacetophenone,4'-benzyloxy-acetophenone,1-4-benzyloxy phenyl ethan-1-one,ethanone, 1-4-phenylmethoxy phenyl,4'-benzyloxy acetophenone,1-4-benzyloxyphenyl ethanone
IUPAC Name 1-(4-phenylmethoxyphenyl)ethanone
InChI Key MKYMYZJJFMPDOA-UHFFFAOYSA-N
Molecular Formula C15H14O2
1,389

4'-Isopropylacetophenone, 97%

CAS: 645-13-6 Molecular Formula: C11H14O Molecular Weight (g/mol): 162.23 MDL Number: MFCD00048297 InChI Key: PDLCCNYKIIUWHA-UHFFFAOYSA-N Synonym: 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one PubChem CID: 12578 IUPAC Name: 1-(4-propan-2-ylphenyl)ethanone SMILES: CC(C)C1=CC=C(C=C1)C(C)=O

PubChem CID 12578
CAS 645-13-6
Molecular Weight (g/mol) 162.23
MDL Number MFCD00048297
SMILES CC(C)C1=CC=C(C=C1)C(C)=O
Synonym 4'-isopropylacetophenone,4-isopropylacetophenone,p-isopropylacetophenone,cuminone,1-4-isopropylphenyl ethanone,ethanone, 1-4-1-methylethyl phenyl,acetophenone, 4'-isopropyl,unii-742zkz2a6d,methyl p-isopropylphenyl ketone,1-4-propan-2-yl phenyl ethan-1-one
IUPAC Name 1-(4-propan-2-ylphenyl)ethanone
InChI Key PDLCCNYKIIUWHA-UHFFFAOYSA-N
Molecular Formula C11H14O
1,390

N-(3-Acetyl-4-hydroxyphenyl)butyramide, 97%

CAS: 40188-45-2 Molecular Formula: C12H15NO3 Molecular Weight (g/mol): 221.26 MDL Number: MFCD00798556 InChI Key: FGWZEOPEZISTTR-UHFFFAOYSA-N Synonym: 2-acetyl-4-butyramidophenol,n-3-acetyl-4-hydroxyphenyl butanamide,n-3-acetyl-4-hydroxyphenyl butyramide,ac-hophe-oh,unii-14qjb65r4v,3'-acetyl-4'-hydroxybutyranilide,butanamide, n-3-acetyl-4-hydroxyphenyl,5'-butyramido-2'-hydroxyacetophenone,acebutolol impurity c,n-3-acetyl-4-hydroxyphenyl butanamid PubChem CID: 736331 IUPAC Name: N-(3-acetyl-4-hydroxyphenyl)butanamide SMILES: CCCC(=O)NC1=CC=C(O)C(=C1)C(C)=O

PubChem CID 736331
CAS 40188-45-2
Molecular Weight (g/mol) 221.26
MDL Number MFCD00798556
SMILES CCCC(=O)NC1=CC=C(O)C(=C1)C(C)=O
Synonym 2-acetyl-4-butyramidophenol,n-3-acetyl-4-hydroxyphenyl butanamide,n-3-acetyl-4-hydroxyphenyl butyramide,ac-hophe-oh,unii-14qjb65r4v,3'-acetyl-4'-hydroxybutyranilide,butanamide, n-3-acetyl-4-hydroxyphenyl,5'-butyramido-2'-hydroxyacetophenone,acebutolol impurity c,n-3-acetyl-4-hydroxyphenyl butanamid
IUPAC Name N-(3-acetyl-4-hydroxyphenyl)butanamide
InChI Key FGWZEOPEZISTTR-UHFFFAOYSA-N
Molecular Formula C12H15NO3
1,391

3'-Aminoacetophenone, 97%

CAS: 99-03-6 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.17 MDL Number: MFCD00007796 InChI Key: CKQHAYFOPRIUOM-UHFFFAOYSA-N Synonym: 3'-aminoacetophenone,1-3-aminophenyl ethanone,m-aminoacetophenone,3-aminoacetophenone,3-acetylaniline,m-acetylaniline,ethanone, 1-3-aminophenyl,1-3-aminophenyl ethan-1-one,m-aminoacetylbenzene,acetophenone, 3'-amino PubChem CID: 7417 IUPAC Name: 1-(3-aminophenyl)ethanone SMILES: CC(=O)C1=CC=CC(N)=C1

PubChem CID 7417
CAS 99-03-6
Molecular Weight (g/mol) 135.17
MDL Number MFCD00007796
SMILES CC(=O)C1=CC=CC(N)=C1
Synonym 3'-aminoacetophenone,1-3-aminophenyl ethanone,m-aminoacetophenone,3-aminoacetophenone,3-acetylaniline,m-acetylaniline,ethanone, 1-3-aminophenyl,1-3-aminophenyl ethan-1-one,m-aminoacetylbenzene,acetophenone, 3'-amino
IUPAC Name 1-(3-aminophenyl)ethanone
InChI Key CKQHAYFOPRIUOM-UHFFFAOYSA-N
Molecular Formula C8H9NO
1,392

4,4'-Dibromobenzil, 97%

CAS: 35578-47-3 Molecular Formula: C14H8Br2O2 MDL Number: MFCD00000104 InChI Key: NYCBYBDDECLFPE-UHFFFAOYSA-N PubChem CID: 96430

PubChem CID 96430
CAS 35578-47-3
MDL Number MFCD00000104
InChI Key NYCBYBDDECLFPE-UHFFFAOYSA-N
Molecular Formula C14H8Br2O2
1,393

4-Allyloxybenzaldehyde, 97%

CAS: 40663-68-1 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00014133 InChI Key: TYNJQOJWNMZQFZ-UHFFFAOYSA-N Synonym: 4-allyloxybenzaldehyde,4-allyloxy benzaldehyde,p-allyloxy benzaldehyde,p-allyloxybenzaldehyde,benzaldehyde, 4-2-propenyloxy,4-prop-2-en-1-yloxy benzaldehyde,4-prop-2-enyloxybenzaldehyde,4-allyloxybenzaldehyd,acmc-20ampt PubChem CID: 95942 IUPAC Name: 4-prop-2-enoxybenzaldehyde SMILES: C=CCOC1=CC=C(C=O)C=C1

PubChem CID 95942
CAS 40663-68-1
Molecular Weight (g/mol) 162.19
MDL Number MFCD00014133
SMILES C=CCOC1=CC=C(C=O)C=C1
Synonym 4-allyloxybenzaldehyde,4-allyloxy benzaldehyde,p-allyloxy benzaldehyde,p-allyloxybenzaldehyde,benzaldehyde, 4-2-propenyloxy,4-prop-2-en-1-yloxy benzaldehyde,4-prop-2-enyloxybenzaldehyde,4-allyloxybenzaldehyd,acmc-20ampt
IUPAC Name 4-prop-2-enoxybenzaldehyde
InChI Key TYNJQOJWNMZQFZ-UHFFFAOYSA-N
Molecular Formula C10H10O2
1,394

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
1,395

Ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate, 97%

CAS: 571-55-1 Molecular Formula: C9H11F3O4 Molecular Weight (g/mol): 240.178 MDL Number: MFCD02677683 InChI Key: XNGGOXOLHQANRB-AATRIKPKSA-N Synonym: ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester PubChem CID: 6185754 IUPAC Name: ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate SMILES: CCOC=C(C(=O)C(F)(F)F)C(=O)OCC

PubChem CID 6185754
CAS 571-55-1
Molecular Weight (g/mol) 240.178
MDL Number MFCD02677683
SMILES CCOC=C(C(=O)C(F)(F)F)C(=O)OCC
Synonym ethyl ethoxymethylene-3-oxo-4,4,4-trifluorobutyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutyrate,e-ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylene-4,4,4-trifluoroacetoacetate,ethyl 2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoate,ethyl ethoxymethylene-3-oxo-4,4,4-trifluoro-butyrate,ethyl 2-ethoxymethylene-4,4,4-trifluoro-3-oxobutanoate,ethyl 2e-3-ethoxy-2-2,2,2-trifluoroacetyl prop-2-enoate,2e-2-ethoxymethylidene-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester
IUPAC Name ethyl (2E)-2-(ethoxymethylidene)-4,4,4-trifluoro-3-oxobutanoate
InChI Key XNGGOXOLHQANRB-AATRIKPKSA-N
Molecular Formula C9H11F3O4