Carbonyl compounds





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Monomethyl monopotassium malonate, 98%
CAS: 38330-80-2 Molecular Formula: C4H5O4·K Molecular Weight (g/mol): 156.18 MDL Number: MFCD00014021 InChI Key: WWTULTKUWBKVGV-UHFFFAOYSA-M Synonym: potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d PubChem CID: 2724687 IUPAC Name: potassium;3-methoxy-3-oxopropanoate SMILES: COC(=O)CC(=O)[O-].[K+]

PubChem CID | 2724687 |
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CAS | 38330-80-2 |
Molecular Weight (g/mol) | 156.18 |
MDL Number | MFCD00014021 |
SMILES | COC(=O)CC(=O)[O-].[K+] |
Synonym | potassium 3-methoxy-3-oxopropanoate,methyl potassium malonate,potassium methyl malonate,propanedioic acid, monomethyl ester, potassium salt,potassium monomethyl malonate,monomethyl malonate potassium salt,hydrogen methyl malonate potassium salt,monomethylpotassiummalonate,acmc-209vp4,ksc226a9d |
IUPAC Name | potassium;3-methoxy-3-oxopropanoate |
InChI Key | WWTULTKUWBKVGV-UHFFFAOYSA-M |
Molecular Formula | C4H5O4·K |
3-Carboxybenzaldehyde, 98%
CAS: 619-21-6 MDL Number: MFCD00039575 InChI Key: UHDNUPHSDMOGCR-UHFFFAOYSA-N Synonym: 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure PubChem CID: 12077 IUPAC Name: 3-formylbenzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C=O

PubChem CID | 12077 |
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CAS | 619-21-6 |
MDL Number | MFCD00039575 |
SMILES | C1=CC(=CC(=C1)C(=O)O)C=O |
Synonym | 3-carboxybenzaldehyde,benzoic acid, 3-formyl,m-formyl benzoic acid,3-formyl benzoic acid,3-formyl-benzoic acid,unii-hb95grm95d,m-carboxybenzaldehyde,hb95grm95d,3-formylbenzoicacid,isophthalaldehydsaure |
IUPAC Name | 3-formylbenzoic acid |
InChI Key | UHDNUPHSDMOGCR-UHFFFAOYSA-N |
Methyl 4-formylbenzoate, 99%
CAS: 1571-08-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00006950 InChI Key: FEIOASZZURHTHB-UHFFFAOYSA-N Synonym: methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate PubChem CID: 15294 IUPAC Name: methyl 4-formylbenzoate SMILES: COC(=O)C1=CC=C(C=O)C=C1

PubChem CID | 15294 |
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CAS | 1571-08-0 |
Molecular Weight (g/mol) | 164.16 |
MDL Number | MFCD00006950 |
SMILES | COC(=O)C1=CC=C(C=O)C=C1 |
Synonym | methyl p-formylbenzoate,4-carbomethoxybenzaldehyde,methyl terephthalaldehydate,4-methoxycarbonyl benzaldehyde,benzoic acid, 4-formyl-, methyl ester,p-carbomethoxybenzaldehyde,methyl terephthaldehydate,methyl4-formylbenzoate,4-formylbenzoic acid methyl ester,methyl-p-formyl benzoate |
IUPAC Name | methyl 4-formylbenzoate |
InChI Key | FEIOASZZURHTHB-UHFFFAOYSA-N |
Molecular Formula | C9H8O3 |
Ethyl 2-methylacetoacetate, 95%
CAS: 609-14-3 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009164 InChI Key: FNENWZWNOPCZGK-UHFFFAOYSA-N Synonym: ethyl 2-methylacetoacetate,ethyl 2-acetylpropionate,ethyl-2-methyl acetoacetate,ethyl methylacetoacetate,ethyl 2-methyl-3-oxobutyrate,ethyl2-methylacetoacetate,butanoic acid, 2-methyl-3-oxo-, ethyl ester,2-methylacetoacetic acid ethyl ester,ethyl alpha-methylacetylacetate,2-methyl-3-oxobutanoic acid ethyl ester PubChem CID: 701 IUPAC Name: ethyl 2-methyl-3-oxobutanoate SMILES: CCOC(=O)C(C)C(=O)C

PubChem CID | 701 |
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CAS | 609-14-3 |
Molecular Weight (g/mol) | 144.17 |
MDL Number | MFCD00009164 |
SMILES | CCOC(=O)C(C)C(=O)C |
Synonym | ethyl 2-methylacetoacetate,ethyl 2-acetylpropionate,ethyl-2-methyl acetoacetate,ethyl methylacetoacetate,ethyl 2-methyl-3-oxobutyrate,ethyl2-methylacetoacetate,butanoic acid, 2-methyl-3-oxo-, ethyl ester,2-methylacetoacetic acid ethyl ester,ethyl alpha-methylacetylacetate,2-methyl-3-oxobutanoic acid ethyl ester |
IUPAC Name | ethyl 2-methyl-3-oxobutanoate |
InChI Key | FNENWZWNOPCZGK-UHFFFAOYSA-N |
Molecular Formula | C7H12O3 |
3'-Hydroxyacetophenone, 99+%
CAS: 121-71-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002298 InChI Key: LUJMEECXHPYQOF-UHFFFAOYSA-N Synonym: 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol PubChem CID: 8487 IUPAC Name: 1-(3-hydroxyphenyl)ethanone SMILES: CC(=O)C1=CC(=CC=C1)O

PubChem CID | 8487 |
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CAS | 121-71-1 |
Molecular Weight (g/mol) | 136.15 |
MDL Number | MFCD00002298 |
SMILES | CC(=O)C1=CC(=CC=C1)O |
Synonym | 3'-hydroxyacetophenone,3-hydroxyacetophenone,1-3-hydroxyphenyl ethanone,m-hydroxyacetophenone,3-acetylphenol,1-3-hydroxyphenyl ethan-1-one,ethanone, 1-3-hydroxyphenyl,m-acetylphenol,3-hydroxy acetophenone,3-acetophenol |
IUPAC Name | 1-(3-hydroxyphenyl)ethanone |
InChI Key | LUJMEECXHPYQOF-UHFFFAOYSA-N |
Molecular Formula | C8H8O2 |
2',6'-Dichloroacetophenone, 97%, Thermo Scientific Chemicals
CAS: 2040-05-3 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.04 MDL Number: MFCD00016339 InChI Key: HYBDSXBLGCQKRE-UHFFFAOYSA-N Synonym: 2',6'-dichloroacetophenone,1-2,6-dichlorophenyl ethanone,2,6-dichloroacetophenone,1-2,6-dichlorophenyl ethan-1-one,ethanone, 1-2,6-dichlorophenyl,2,6-dichloro acetophenone,1-acetyl-2,6-dichlorobenzene,zlchem 1084,pubchem12362,acmc-1cobf PubChem CID: 74877 IUPAC Name: 1-(2,6-dichlorophenyl)ethanone SMILES: CC(=O)C1=C(C=CC=C1Cl)Cl

PubChem CID | 74877 |
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CAS | 2040-05-3 |
Molecular Weight (g/mol) | 189.04 |
MDL Number | MFCD00016339 |
SMILES | CC(=O)C1=C(C=CC=C1Cl)Cl |
Synonym | 2',6'-dichloroacetophenone,1-2,6-dichlorophenyl ethanone,2,6-dichloroacetophenone,1-2,6-dichlorophenyl ethan-1-one,ethanone, 1-2,6-dichlorophenyl,2,6-dichloro acetophenone,1-acetyl-2,6-dichlorobenzene,zlchem 1084,pubchem12362,acmc-1cobf |
IUPAC Name | 1-(2,6-dichlorophenyl)ethanone |
InChI Key | HYBDSXBLGCQKRE-UHFFFAOYSA-N |
Molecular Formula | C8H6Cl2O |
4-Acetylbenzoic acid, 98%
CAS: 586-89-0 Molecular Formula: C9H8O3 Molecular Weight (g/mol): 164.16 MDL Number: MFCD00002561 InChI Key: QBHDSQZASIBAAI-UHFFFAOYSA-N Synonym: benzoic acid, 4-acetyl,p-acetylbenzoic acid,4-acetyl-benzoic acid,4'-acetophenonecarboxylic acid,4-acetylbezoic acid,4-acetylbenzoci acid,4'-carboxyacetohenone,pubchem3129,4-acetyl benzoic acid PubChem CID: 11470 IUPAC Name: 4-acetylbenzoic acid SMILES: CC(=O)C1=CC=C(C=C1)C(=O)O

PubChem CID | 11470 |
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CAS | 586-89-0 |
Molecular Weight (g/mol) | 164.16 |
MDL Number | MFCD00002561 |
SMILES | CC(=O)C1=CC=C(C=C1)C(=O)O |
Synonym | benzoic acid, 4-acetyl,p-acetylbenzoic acid,4-acetyl-benzoic acid,4'-acetophenonecarboxylic acid,4-acetylbezoic acid,4-acetylbenzoci acid,4'-carboxyacetohenone,pubchem3129,4-acetyl benzoic acid |
IUPAC Name | 4-acetylbenzoic acid |
InChI Key | QBHDSQZASIBAAI-UHFFFAOYSA-N |
Molecular Formula | C9H8O3 |
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 |
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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 |
4-Chromanone, 96%
CAS: 491-37-2 Molecular Formula: C9H8O2 Molecular Weight (g/mol): 148.16 MDL Number: MFCD00006840 InChI Key: MSTDXOZUKAQDRL-UHFFFAOYSA-N Synonym: 4-chromanone,chroman-4-one,chromanone,4h-1-benzopyran-4-one, 2,3-dihydro,2,3-dihydro-4h-chromen-4-one,2,3-dihydro-1-benzopyran-4-one,isochromanone,3,4-dihydro-2h-1-benzopyran-4-one,2,3-dihydro-4h-1-benzopyran-4-one,dihydrochromone PubChem CID: 68110 IUPAC Name: 2,3-dihydrochromen-4-one SMILES: C1COC2=CC=CC=C2C1=O

PubChem CID | 68110 |
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CAS | 491-37-2 |
Molecular Weight (g/mol) | 148.16 |
MDL Number | MFCD00006840 |
SMILES | C1COC2=CC=CC=C2C1=O |
Synonym | 4-chromanone,chroman-4-one,chromanone,4h-1-benzopyran-4-one, 2,3-dihydro,2,3-dihydro-4h-chromen-4-one,2,3-dihydro-1-benzopyran-4-one,isochromanone,3,4-dihydro-2h-1-benzopyran-4-one,2,3-dihydro-4h-1-benzopyran-4-one,dihydrochromone |
IUPAC Name | 2,3-dihydrochromen-4-one |
InChI Key | MSTDXOZUKAQDRL-UHFFFAOYSA-N |
Molecular Formula | C9H8O2 |
2,2-Diethoxyacetophenone, 96%
CAS: 6175-45-7 Molecular Formula: C12H16O3 Molecular Weight (g/mol): 208.26 MDL Number: MFCD00009659 InChI Key: PIZHFBODNLEQBL-UHFFFAOYSA-N Synonym: 2,2-diethoxyacetophenone,ethanone, 2,2-diethoxy-1-phenyl,phenylglyoxal diethyl acetal,2,2-diethoxy-1-phenylethan-1-one,alpha,alpha-diethoxyacetophenone,unii-w4bcz1mak3,2,2-diethoxy acetophenone,ccris 5222,benzoylformaldehyde diethyl acetal,glyoxal, phenyl-, 2-diethyl acetal PubChem CID: 22555 IUPAC Name: 2,2-diethoxy-1-phenylethanone SMILES: CCOC(OCC)C(=O)C1=CC=CC=C1

PubChem CID | 22555 |
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CAS | 6175-45-7 |
Molecular Weight (g/mol) | 208.26 |
MDL Number | MFCD00009659 |
SMILES | CCOC(OCC)C(=O)C1=CC=CC=C1 |
Synonym | 2,2-diethoxyacetophenone,ethanone, 2,2-diethoxy-1-phenyl,phenylglyoxal diethyl acetal,2,2-diethoxy-1-phenylethan-1-one,alpha,alpha-diethoxyacetophenone,unii-w4bcz1mak3,2,2-diethoxy acetophenone,ccris 5222,benzoylformaldehyde diethyl acetal,glyoxal, phenyl-, 2-diethyl acetal |
IUPAC Name | 2,2-diethoxy-1-phenylethanone |
InChI Key | PIZHFBODNLEQBL-UHFFFAOYSA-N |
Molecular Formula | C12H16O3 |
Droperidol
CAS: 548-73-2 Molecular Formula: C22H22FN3O2 Molecular Weight (g/mol): 379.43 InChI Key: RMEDXOLNCUSCGS-UHFFFAOYSA-N Synonym: droperidol,droleptan,inapsine,dehydrobenzperidol,properidol,sintodril,sintosian,inapsin,vetkalm,dridol PubChem CID: 3168 ChEBI: CHEBI:4717 IUPAC Name: 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one SMILES: C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F

PubChem CID | 3168 |
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CAS | 548-73-2 |
Molecular Weight (g/mol) | 379.43 |
ChEBI | CHEBI:4717 |
SMILES | C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F |
Synonym | droperidol,droleptan,inapsine,dehydrobenzperidol,properidol,sintodril,sintosian,inapsin,vetkalm,dridol |
IUPAC Name | 3-[1-[4-(4-fluorophenyl)-4-oxobutyl]-3,6-dihydro-2H-pyridin-4-yl]-1H-benzimidazol-2-one |
InChI Key | RMEDXOLNCUSCGS-UHFFFAOYSA-N |
Molecular Formula | C22H22FN3O2 |
3-Chloro-4-pyridinecarboxaldehyde, 97%
CAS: 72990-37-5 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.56 MDL Number: MFCD06200712 InChI Key: ZVGDKOQPJCOCLI-UHFFFAOYSA-N Synonym: 3-chloroisonicotinaldehyde,3-chloropyridine-4-carboxaldehyde,3-chloro-4-pyridinecarboxaldehyde,3-chloro-4-pyridinecarbaldehyde,3-chloro-pyridine-4-carbaldehyde,3-chloro-4-formylpyridine,4-pyridinecarboxaldehyde, 3-chloro,acmc-1bgrb,ksc377a6f PubChem CID: 2762995 IUPAC Name: 3-chloropyridine-4-carbaldehyde SMILES: C1=CN=CC(=C1C=O)Cl

PubChem CID | 2762995 |
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CAS | 72990-37-5 |
Molecular Weight (g/mol) | 141.56 |
MDL Number | MFCD06200712 |
SMILES | C1=CN=CC(=C1C=O)Cl |
Synonym | 3-chloroisonicotinaldehyde,3-chloropyridine-4-carboxaldehyde,3-chloro-4-pyridinecarboxaldehyde,3-chloro-4-pyridinecarbaldehyde,3-chloro-pyridine-4-carbaldehyde,3-chloro-4-formylpyridine,4-pyridinecarboxaldehyde, 3-chloro,acmc-1bgrb,ksc377a6f |
IUPAC Name | 3-chloropyridine-4-carbaldehyde |
InChI Key | ZVGDKOQPJCOCLI-UHFFFAOYSA-N |
Molecular Formula | C6H4ClNO |
2-Bromo-3'-hydroxyacetophenone, 96%
CAS: 2491-37-4 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.04 MDL Number: MFCD05664326 InChI Key: IEPSGFQQGKPTPM-UHFFFAOYSA-N PubChem CID: 6917206 IUPAC Name: 2-bromo-1-(3-hydroxyphenyl)ethanone SMILES: C1=CC(=CC(=C1)O)C(=O)CBr

PubChem CID | 6917206 |
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CAS | 2491-37-4 |
Molecular Weight (g/mol) | 215.04 |
MDL Number | MFCD05664326 |
SMILES | C1=CC(=CC(=C1)O)C(=O)CBr |
IUPAC Name | 2-bromo-1-(3-hydroxyphenyl)ethanone |
InChI Key | IEPSGFQQGKPTPM-UHFFFAOYSA-N |
Molecular Formula | C8H7BrO2 |
Ethyl 2-nitrobenzoylacetate, 97%
CAS: 52119-39-8 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.21 MDL Number: MFCD03424821 InChI Key: OWZNCVIBJQPNEF-UHFFFAOYSA-N Synonym: ethyl 3-2-nitrophenyl-3-oxopropanoate,ethyl 2-nitrobenzoylacetate,acmc-1awhb,ethyl 3-2-nitrophenyl-3-oxo-propanoate,ethyl o-nitrobenzoylacetate,ethyl 2-o-nitrobenzoyl acetate,ethyl 2-2-nitrobenzoyl acetate,ethyl 2-o-nitrobenzoyl-acetate,ethyl 2-nitrobenzoyl acetate PubChem CID: 10561837 IUPAC Name: ethyl 3-(2-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1[N+](=O)[O-]

PubChem CID | 10561837 |
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CAS | 52119-39-8 |
Molecular Weight (g/mol) | 237.21 |
MDL Number | MFCD03424821 |
SMILES | CCOC(=O)CC(=O)C1=CC=CC=C1[N+](=O)[O-] |
Synonym | ethyl 3-2-nitrophenyl-3-oxopropanoate,ethyl 2-nitrobenzoylacetate,acmc-1awhb,ethyl 3-2-nitrophenyl-3-oxo-propanoate,ethyl o-nitrobenzoylacetate,ethyl 2-o-nitrobenzoyl acetate,ethyl 2-2-nitrobenzoyl acetate,ethyl 2-o-nitrobenzoyl-acetate,ethyl 2-nitrobenzoyl acetate |
IUPAC Name | ethyl 3-(2-nitrophenyl)-3-oxopropanoate |
InChI Key | OWZNCVIBJQPNEF-UHFFFAOYSA-N |
Molecular Formula | C11H11NO5 |
3-Dimethylaminoacrolein, 90%
CAS: 927-63-9 Molecular Formula: C5H9NO Molecular Weight (g/mol): 99.13 MDL Number: MFCD00006999 InChI Key: RRLMPLDPCKRASL-ONEGZZNKSA-N Synonym: 3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein PubChem CID: 638320 SMILES: CN(C)\C=C\C=O

PubChem CID | 638320 |
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CAS | 927-63-9 |
Molecular Weight (g/mol) | 99.13 |
MDL Number | MFCD00006999 |
SMILES | CN(C)\C=C\C=O |
Synonym | 3-dimethylaminoacrolein,3-dimethylaminoacrylaldehyde,3-dimethylamino acrylaldehyde,3-dimethylamino acrolein,2-propenal, 3-dimethylamino,e-3-dimethylamino acrylaldehyde,e-3-dimethylamino prop-2-enal,3-dimethylamino propenal,2e-3-dimethylamino prop-2-enal,.beta.-dimethylamino acrolein |
InChI Key | RRLMPLDPCKRASL-ONEGZZNKSA-N |
Molecular Formula | C5H9NO |