Carbonyl compounds
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1-Methylpyrazole-5-carboxaldehyde 95.0+%, TCI America™
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CAS: 27258-33-9 Molecular Formula: C5H6N2O Molecular Weight (g/mol): 110.12 MDL Number: MFCD03419801 InChI Key: RAJRANFZSWDUJZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 PubChem CID: 7019414 IUPAC Name: 1-methyl-1H-pyrazole-5-carbaldehyde SMILES: CN1N=CC=C1C=O
| PubChem CID | 7019414 |
|---|---|
| CAS | 27258-33-9 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD03419801 |
| SMILES | CN1N=CC=C1C=O |
| Synonym | 1-methyl-1h-pyrazole-5-carbaldehyde,2-methyl-2h-pyrazole-3-carbaldehyde,5-formyl-1-methyl-1h-pyrazole,1-methylpyrazole-5-carboxaldehyde,5-formyl-1-methylpyrazole,1-methylpyrazole-5-carbaldehyde,1h-pyrazole-5-carboxaldehyde, 1-methyl,1-methyl-1h-pyrazole-5-carboxaldehyde,pubchem16289,acmc-209gw7 |
| IUPAC Name | 1-methyl-1H-pyrazole-5-carbaldehyde |
| InChI Key | RAJRANFZSWDUJZ-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O |
Bis(trifluoro-2,4-pentanedionato)cobalt(II) Hydrate 90.0+%, TCI America™
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CAS: 16092-38-9 Molecular Formula: C10H10CoF6O4 Molecular Weight (g/mol): 367.11 MDL Number: MFCD00044994 InChI Key: GCHODJIKBYKCNY-UHFFFAOYSA-N Synonym: Cobalt(II) Trifluoroacetylacetonate, Trifluoroacetylacetono Cobalt(II) Salt PubChem CID: 102601710 IUPAC Name: bis(5,5,5-trifluoro-4-hydroxypent-3-en-2-one) cobalt SMILES: [Co].CC(=O)C=C(O)C(F)(F)F.CC(=O)C=C(O)C(F)(F)F
| PubChem CID | 102601710 |
|---|---|
| CAS | 16092-38-9 |
| Molecular Weight (g/mol) | 367.11 |
| MDL Number | MFCD00044994 |
| SMILES | [Co].CC(=O)C=C(O)C(F)(F)F.CC(=O)C=C(O)C(F)(F)F |
| Synonym | Cobalt(II) Trifluoroacetylacetonate, Trifluoroacetylacetono Cobalt(II) Salt |
| IUPAC Name | bis(5,5,5-trifluoro-4-hydroxypent-3-en-2-one) cobalt |
| InChI Key | GCHODJIKBYKCNY-UHFFFAOYSA-N |
| Molecular Formula | C10H10CoF6O4 |
4'-Diethylaminoacetophenone 98.0+%, TCI America™
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CAS: 5520-66-1 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.27 MDL Number: MFCD00043651 InChI Key: HMIBQFXWSUBFTG-UHFFFAOYSA-N Synonym: 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline PubChem CID: 138529 IUPAC Name: 1-[4-(diethylamino)phenyl]ethan-1-one SMILES: CCN(CC)C1=CC=C(C=C1)C(C)=O
| PubChem CID | 138529 |
|---|---|
| CAS | 5520-66-1 |
| Molecular Weight (g/mol) | 191.27 |
| MDL Number | MFCD00043651 |
| SMILES | CCN(CC)C1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-diethylaminoacetophenone,p-diethylaminoacetophenone,4-diethylaminoacetophenone,1-4-diethylamino phenyl ethanone,ethanone, 1-4-diethylamino phenyl,1-acetyl-4-diethylamino benzene,acmc-1aspz,4-acetyl-n,n-diethylaniline |
| IUPAC Name | 1-[4-(diethylamino)phenyl]ethan-1-one |
| InChI Key | HMIBQFXWSUBFTG-UHFFFAOYSA-N |
| Molecular Formula | C12H17NO |
Dimethyl Cyclopentylmalonate 97.0+%, TCI America™
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CAS: 82491-60-9 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.234 MDL Number: MFCD03844781 InChI Key: KCCNEJJMJHDVCN-UHFFFAOYSA-N Synonym: Cyclopentylmalonic Acid Dimethyl Ester PubChem CID: 14831157 IUPAC Name: dimethyl 2-cyclopentylpropanedioate SMILES: COC(=O)C(C1CCCC1)C(=O)OC
| PubChem CID | 14831157 |
|---|---|
| CAS | 82491-60-9 |
| Molecular Weight (g/mol) | 200.234 |
| MDL Number | MFCD03844781 |
| SMILES | COC(=O)C(C1CCCC1)C(=O)OC |
| Synonym | Cyclopentylmalonic Acid Dimethyl Ester |
| IUPAC Name | dimethyl 2-cyclopentylpropanedioate |
| InChI Key | KCCNEJJMJHDVCN-UHFFFAOYSA-N |
| Molecular Formula | C10H16O4 |
2'-Methoxyacetophenone 97.0+%, TCI America™
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CAS: 579-74-8 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008725 InChI Key: DWPLEOPKBWNPQV-UHFFFAOYSA-N Synonym: 2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone PubChem CID: 68481 IUPAC Name: 1-(2-methoxyphenyl)ethan-1-one SMILES: COC1=CC=CC=C1C(C)=O
| PubChem CID | 68481 |
|---|---|
| CAS | 579-74-8 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00008725 |
| SMILES | COC1=CC=CC=C1C(C)=O |
| Synonym | 2'-methoxyacetophenone,1-2-methoxyphenyl ethanone,o-methoxyacetophenone,ethanone, 1-2-methoxyphenyl,o-acetylanisole,1-2-methoxyphenyl ethan-1-one,o-acetanisole,2-acetylanisole,2-methyoxyacetophenone oxime,ortho-methoxyacetophenone |
| IUPAC Name | 1-(2-methoxyphenyl)ethan-1-one |
| InChI Key | DWPLEOPKBWNPQV-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
3-Benzoylpropionic Acid 98.0+%, TCI America™
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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
| 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 |
2-Allyloxybenzaldehyde 96.0+%, TCI America™
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CAS: 28752-82-1 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.188 MDL Number: MFCD00014130 InChI Key: BXCJDECTRRMSCV-UHFFFAOYSA-N Synonym: 2-allyloxy benzaldehyde,2-allyloxybenzaldehyde,o-allyloxy benzaldehyde,o-allyloxybenzaldehyde,benzaldehyde, 2-2-propenyloxy,benzaldehyde, o-allyloxy,2-prop-2-en-1-yloxy benzaldehyde,2-prop-2-enyloxybenzaldehyde,allylsalicylaldehyde,o-allylsalicylaldehyde PubChem CID: 101335 IUPAC Name: 2-prop-2-enoxybenzaldehyde SMILES: C=CCOC1=CC=CC=C1C=O
| PubChem CID | 101335 |
|---|---|
| CAS | 28752-82-1 |
| Molecular Weight (g/mol) | 162.188 |
| MDL Number | MFCD00014130 |
| SMILES | C=CCOC1=CC=CC=C1C=O |
| Synonym | 2-allyloxy benzaldehyde,2-allyloxybenzaldehyde,o-allyloxy benzaldehyde,o-allyloxybenzaldehyde,benzaldehyde, 2-2-propenyloxy,benzaldehyde, o-allyloxy,2-prop-2-en-1-yloxy benzaldehyde,2-prop-2-enyloxybenzaldehyde,allylsalicylaldehyde,o-allylsalicylaldehyde |
| IUPAC Name | 2-prop-2-enoxybenzaldehyde |
| InChI Key | BXCJDECTRRMSCV-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
3,3-Dibromo-1,1,1-trifluoroacetone 98.0+%, TCI America™
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CAS: 431-67-4 Molecular Formula: C3HBr2F3O Molecular Weight (g/mol): 269.843 MDL Number: MFCD00041362 InChI Key: HEPPAPZASXFWTB-UHFFFAOYSA-N Synonym: 1,1-dibromo-3,3,3-trifluoroacetone,3,3-dibromo-1,1,1-trifluoroacetone,3,3-dibromo-1,1,1-trifluoro-propan-2-one,2-propanone, 3,3-dibromo-1,1,1-trifluoro,dibromotrifluoroaceton,pubchem12627,3,3-dibromotrifluoroacetone,ksc237m8t,l,l-dibromo-3,3,3-trifluoroacetone,1,1-di-bromo-3,3,3-trifluoroacetone PubChem CID: 550523 IUPAC Name: 3,3-dibromo-1,1,1-trifluoropropan-2-one SMILES: C(C(=O)C(F)(F)F)(Br)Br
| PubChem CID | 550523 |
|---|---|
| CAS | 431-67-4 |
| Molecular Weight (g/mol) | 269.843 |
| MDL Number | MFCD00041362 |
| SMILES | C(C(=O)C(F)(F)F)(Br)Br |
| Synonym | 1,1-dibromo-3,3,3-trifluoroacetone,3,3-dibromo-1,1,1-trifluoroacetone,3,3-dibromo-1,1,1-trifluoro-propan-2-one,2-propanone, 3,3-dibromo-1,1,1-trifluoro,dibromotrifluoroaceton,pubchem12627,3,3-dibromotrifluoroacetone,ksc237m8t,l,l-dibromo-3,3,3-trifluoroacetone,1,1-di-bromo-3,3,3-trifluoroacetone |
| IUPAC Name | 3,3-dibromo-1,1,1-trifluoropropan-2-one |
| InChI Key | HEPPAPZASXFWTB-UHFFFAOYSA-N |
| Molecular Formula | C3HBr2F3O |
4-Fluorobenzoylacetonitrile 98.0+%, TCI America™
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CAS: 4640-67-9 Molecular Formula: C9H6FNO Molecular Weight (g/mol): 163.15 MDL Number: MFCD00662062 InChI Key: LOJBBLDAJBJVBZ-UHFFFAOYSA-N Synonym: 4-fluorobenzoylacetonitrile,3-4-fluorophenyl-3-oxopropanenitrile,p-fluorobenzoylacetonitrile,unii-k1ltb8k2dh,3-4-fluorophenyl-3-oxopropionitrile,k1ltb8k2dh,3-4-fluoro-phenyl-3-oxo-propionitrile,benzenepropanenitrile, 4-fluoro-beta-oxo,alpha-cyano-4-fluoroacetophenone,acetonitrile, p-fluorobenzoyl PubChem CID: 2783172 IUPAC Name: 3-(4-fluorophenyl)-3-oxopropanenitrile SMILES: FC1=CC=C(C=C1)C(=O)CC#N
| PubChem CID | 2783172 |
|---|---|
| CAS | 4640-67-9 |
| Molecular Weight (g/mol) | 163.15 |
| MDL Number | MFCD00662062 |
| SMILES | FC1=CC=C(C=C1)C(=O)CC#N |
| Synonym | 4-fluorobenzoylacetonitrile,3-4-fluorophenyl-3-oxopropanenitrile,p-fluorobenzoylacetonitrile,unii-k1ltb8k2dh,3-4-fluorophenyl-3-oxopropionitrile,k1ltb8k2dh,3-4-fluoro-phenyl-3-oxo-propionitrile,benzenepropanenitrile, 4-fluoro-beta-oxo,alpha-cyano-4-fluoroacetophenone,acetonitrile, p-fluorobenzoyl |
| IUPAC Name | 3-(4-fluorophenyl)-3-oxopropanenitrile |
| InChI Key | LOJBBLDAJBJVBZ-UHFFFAOYSA-N |
| Molecular Formula | C9H6FNO |
1-Chloroanthraquinone 98.0+%, TCI America™
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CAS: 82-44-0 Molecular Formula: C14H7ClO2 Molecular Weight (g/mol): 242.658 MDL Number: MFCD00001189 InChI Key: BOCJQSFSGAZAPQ-UHFFFAOYSA-N Synonym: 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v PubChem CID: 6709 IUPAC Name: 1-chloroanthracene-9,10-dione SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl
| PubChem CID | 6709 |
|---|---|
| CAS | 82-44-0 |
| Molecular Weight (g/mol) | 242.658 |
| MDL Number | MFCD00001189 |
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)Cl |
| Synonym | 1-chloroanthraquinone,1-chloro anthraquinone,anthraquinone, 1-chloro,1-chloro-9,10-anthraquinone,9,10-anthracenedione, 1-chloro,1-chloranthrachinon,1-chloranthrachinon czech,alpha-chloroanthraquinone,alpha-monochloroanthraquinone,unii-96s5sqv15v |
| IUPAC Name | 1-chloroanthracene-9,10-dione |
| InChI Key | BOCJQSFSGAZAPQ-UHFFFAOYSA-N |
| Molecular Formula | C14H7ClO2 |
Dibenzofuran-4-carboxaldehyde 98.0+%, TCI America™
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CAS: 96706-46-6 Molecular Formula: C13H8O2 Molecular Weight (g/mol): 196.205 MDL Number: MFCD03306027 InChI Key: GQYTWBPRZFRASB-UHFFFAOYSA-N PubChem CID: 126043 IUPAC Name: dibenzofuran-4-carbaldehyde SMILES: C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C=O
| PubChem CID | 126043 |
|---|---|
| CAS | 96706-46-6 |
| Molecular Weight (g/mol) | 196.205 |
| MDL Number | MFCD03306027 |
| SMILES | C1=CC=C2C(=C1)C3=C(O2)C(=CC=C3)C=O |
| IUPAC Name | dibenzofuran-4-carbaldehyde |
| InChI Key | GQYTWBPRZFRASB-UHFFFAOYSA-N |
| Molecular Formula | C13H8O2 |
2-Bromo-2'-(trifluoromethyl)acetophenone 98.0+%, TCI America™
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CAS: 54109-16-9 Molecular Formula: C9H6BrF3O Molecular Weight (g/mol): 267.045 MDL Number: MFCD03094304 InChI Key: KWZCBMKXNYOQAK-UHFFFAOYSA-N Synonym: 2-trifluoromethyl phenacyl bromide,2-bromo-1-2-trifluoromethyl phenyl-1-ethanone,2-bromo-2'-trifluoromethyl acetophenone,2-bromo-1-2-trifluoromethyl-phenyl-ethanone,2-bromo-1-2-trifluoromethyl phenyl ethan-1-one,2-bromo-1-2-trifluoromethyl phenyl ethanone,ethanone, 2-bromo-1-2-trifluoromethyl phenyl,2-trifluoromethyphenacyl bromide,2-trifluoromethyl phenacylbromide PubChem CID: 2778430 IUPAC Name: 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F
| PubChem CID | 2778430 |
|---|---|
| CAS | 54109-16-9 |
| Molecular Weight (g/mol) | 267.045 |
| MDL Number | MFCD03094304 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)C(F)(F)F |
| Synonym | 2-trifluoromethyl phenacyl bromide,2-bromo-1-2-trifluoromethyl phenyl-1-ethanone,2-bromo-2'-trifluoromethyl acetophenone,2-bromo-1-2-trifluoromethyl-phenyl-ethanone,2-bromo-1-2-trifluoromethyl phenyl ethan-1-one,2-bromo-1-2-trifluoromethyl phenyl ethanone,ethanone, 2-bromo-1-2-trifluoromethyl phenyl,2-trifluoromethyphenacyl bromide,2-trifluoromethyl phenacylbromide |
| IUPAC Name | 2-bromo-1-[2-(trifluoromethyl)phenyl]ethanone |
| InChI Key | KWZCBMKXNYOQAK-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrF3O |
2-Acetyl-5-chlorothiophene 99.0+%, TCI America™
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CAS: 6310-09-4 Molecular Formula: C6H5ClOS Molecular Weight (g/mol): 160.62 MDL Number: MFCD00005444 InChI Key: HTZGPEHWQCRXGZ-UHFFFAOYSA-N Synonym: 2-acetyl-5-chlorothiophene,1-5-chlorothiophen-2-yl ethanone,1-5-chloro-2-thienyl ethanone,5-chloro-2-acetylthiophene,ethanone, 1-5-chloro-2-thienyl,5-chlor-2-acetyl thiophen,ketone, 5-chloro-2-thienyl methyl,1-5-chlorothiophen-2-yl ethan-1-one,5-chloro-2-thienyl methyl ketone,2-chloro-5-acetylthiophene PubChem CID: 80572 IUPAC Name: 1-(5-chlorothiophen-2-yl)ethanone SMILES: CC(=O)C1=CC=C(S1)Cl
| PubChem CID | 80572 |
|---|---|
| CAS | 6310-09-4 |
| Molecular Weight (g/mol) | 160.62 |
| MDL Number | MFCD00005444 |
| SMILES | CC(=O)C1=CC=C(S1)Cl |
| Synonym | 2-acetyl-5-chlorothiophene,1-5-chlorothiophen-2-yl ethanone,1-5-chloro-2-thienyl ethanone,5-chloro-2-acetylthiophene,ethanone, 1-5-chloro-2-thienyl,5-chlor-2-acetyl thiophen,ketone, 5-chloro-2-thienyl methyl,1-5-chlorothiophen-2-yl ethan-1-one,5-chloro-2-thienyl methyl ketone,2-chloro-5-acetylthiophene |
| IUPAC Name | 1-(5-chlorothiophen-2-yl)ethanone |
| InChI Key | HTZGPEHWQCRXGZ-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClOS |
tert-Butyl 4-Formylbenzoate 98.0+%, TCI America™
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CAS: 65874-27-3 Molecular Formula: C12H14O3 Molecular Weight (g/mol): 206.241 MDL Number: MFCD01111994 InChI Key: DUNFNBQQWYQKFE-UHFFFAOYSA-N Synonym: 4-Formylbenzoic Acid tert-Butyl Ester, 4-(tert-Butoxycarbonyl)benzaldehyde PubChem CID: 2751588 IUPAC Name: tert-butyl 4-formylbenzoate SMILES: CC(C)(C)OC(=O)C1=CC=C(C=C1)C=O
| PubChem CID | 2751588 |
|---|---|
| CAS | 65874-27-3 |
| Molecular Weight (g/mol) | 206.241 |
| MDL Number | MFCD01111994 |
| SMILES | CC(C)(C)OC(=O)C1=CC=C(C=C1)C=O |
| Synonym | 4-Formylbenzoic Acid tert-Butyl Ester, 4-(tert-Butoxycarbonyl)benzaldehyde |
| IUPAC Name | tert-butyl 4-formylbenzoate |
| InChI Key | DUNFNBQQWYQKFE-UHFFFAOYSA-N |
| Molecular Formula | C12H14O3 |
6-Quinolinecarboxaldehyde 98.0+%, TCI America™
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CAS: 4113-04-6 Molecular Formula: C10H7NO Molecular Weight (g/mol): 157.17 MDL Number: MFCD00805836 InChI Key: VUAOIXANWIFYCU-UHFFFAOYSA-N Synonym: 6-Formylquinoline PubChem CID: 765653 IUPAC Name: quinoline-6-carbaldehyde SMILES: C1=CC2=C(C=CC(=C2)C=O)N=C1
| PubChem CID | 765653 |
|---|---|
| CAS | 4113-04-6 |
| Molecular Weight (g/mol) | 157.17 |
| MDL Number | MFCD00805836 |
| SMILES | C1=CC2=C(C=CC(=C2)C=O)N=C1 |
| Synonym | 6-Formylquinoline |
| IUPAC Name | quinoline-6-carbaldehyde |
| InChI Key | VUAOIXANWIFYCU-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO |