Carbonyl compounds
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Butyrophenone 99.0+%, TCI America™
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CAS: 495-40-9 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00009397 InChI Key: FFSAXUULYPJSKH-UHFFFAOYSA-N Synonym: butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone PubChem CID: 10315 IUPAC Name: 1-phenylbutan-1-one SMILES: CCCC(=O)C1=CC=CC=C1
| PubChem CID | 10315 |
|---|---|
| CAS | 495-40-9 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00009397 |
| SMILES | CCCC(=O)C1=CC=CC=C1 |
| Synonym | butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone |
| IUPAC Name | 1-phenylbutan-1-one |
| InChI Key | FFSAXUULYPJSKH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
D-Psicose 99.0+%, TCI America™
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CAS: 551-68-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00083478 InChI Key: BJHIKXHVCXFQLS-PUFIMZNGSA-N Synonym: erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose PubChem CID: 90008 ChEBI: CHEBI:27605 IUPAC Name: (3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O
| PubChem CID | 90008 |
|---|---|
| CAS | 551-68-8 |
| Molecular Weight (g/mol) | 180.156 |
| ChEBI | CHEBI:27605 |
| MDL Number | MFCD00083478 |
| SMILES | C(C(C(C(C(=O)CO)O)O)O)O |
| Synonym | erythrohexulose,3r,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,pseudofructose,unii-qcc18lng3e,d-ribo-hex-2-ulose,qcc18lng3e,dl-psicose,ribo-2-hexulose,d-ribo-2-ketohexose,keto-d-psicose |
| IUPAC Name | (3R,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one |
| InChI Key | BJHIKXHVCXFQLS-PUFIMZNGSA-N |
| Molecular Formula | C6H12O6 |
2-Ethylhexanal 95.0+%, TCI America™
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CAS: 123-05-7 Molecular Formula: C8H16O Molecular Weight (g/mol): 128.215 MDL Number: MFCD00006987 InChI Key: LGYNIFWIKSEESD-UHFFFAOYSA-N Synonym: hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde PubChem CID: 31241 IUPAC Name: 2-ethylhexanal SMILES: CCCCC(CC)C=O
| PubChem CID | 31241 |
|---|---|
| CAS | 123-05-7 |
| Molecular Weight (g/mol) | 128.215 |
| MDL Number | MFCD00006987 |
| SMILES | CCCCC(CC)C=O |
| Synonym | hexanal, 2-ethyl,2-ethylhexaldehyde,2-ethylhexylaldehyde,3-formylheptane,2-ethylcaproaldehyde,butylethylacetaldehyde,ethylbutylacetaldehyde,ethylhexaldehyde,alpha-ethylcaproaldehyde,butyl ethyl acetaldehyde |
| IUPAC Name | 2-ethylhexanal |
| InChI Key | LGYNIFWIKSEESD-UHFFFAOYSA-N |
| Molecular Formula | C8H16O |
Diethyl 1,3-Acetonedicarboxylate 95.0+%, TCI America™
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CAS: 105-50-0 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.21 MDL Number: MFCD00009200 InChI Key: ZSANYRMTSBBUCA-UHFFFAOYSA-N Synonym: diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester PubChem CID: 66045 IUPAC Name: 1,5-diethyl 3-oxopentanedioate SMILES: CCOC(=O)CC(=O)CC(=O)OCC
| PubChem CID | 66045 |
|---|---|
| CAS | 105-50-0 |
| Molecular Weight (g/mol) | 202.21 |
| MDL Number | MFCD00009200 |
| SMILES | CCOC(=O)CC(=O)CC(=O)OCC |
| Synonym | diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester |
| IUPAC Name | 1,5-diethyl 3-oxopentanedioate |
| InChI Key | ZSANYRMTSBBUCA-UHFFFAOYSA-N |
| Molecular Formula | C9H14O5 |
Imidazole-2-carboxaldehyde 98.0+%, TCI America™
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CAS: 10111-08-7 Molecular Formula: C4H4N2O Molecular Weight (g/mol): 96.09 MDL Number: MFCD00003544 InChI Key: XYHKNCXZYYTLRG-UHFFFAOYSA-N Synonym: imidazole-2-carboxaldehyde,2-formylimidazole,1h-imidazole-2-carboxaldehyde,imidazole-2-carbaldehyde,2-imidazolecarboxaldehyde,imidazole-2-aldehyde,1h-imidazolecarboxaldehyde,2-formyl imidazole,imidazol-2-carbaldehyde,2-formyl-1h-imidazole PubChem CID: 24955 IUPAC Name: 1H-imidazole-2-carbaldehyde SMILES: O=CC1=NC=CN1
| PubChem CID | 24955 |
|---|---|
| CAS | 10111-08-7 |
| Molecular Weight (g/mol) | 96.09 |
| MDL Number | MFCD00003544 |
| SMILES | O=CC1=NC=CN1 |
| Synonym | imidazole-2-carboxaldehyde,2-formylimidazole,1h-imidazole-2-carboxaldehyde,imidazole-2-carbaldehyde,2-imidazolecarboxaldehyde,imidazole-2-aldehyde,1h-imidazolecarboxaldehyde,2-formyl imidazole,imidazol-2-carbaldehyde,2-formyl-1h-imidazole |
| IUPAC Name | 1H-imidazole-2-carbaldehyde |
| InChI Key | XYHKNCXZYYTLRG-UHFFFAOYSA-N |
| Molecular Formula | C4H4N2O |
2,6-Dichloroindophenol Sodium Salt Dihydrate 95.0+%, TCI America™
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CAS: 620-45-1 Molecular Formula: C12H6Cl2NNaO2 Molecular Weight (g/mol): 290.07 MDL Number: MFCD00150014 InChI Key: FHLDWQLHDYCXKI-UHFFFAOYSA-M Synonym: 2,6-dichloroindophenol sodium salt,2,6-dichlorophenolindophenol sodium salt,tillman's reagent,tillman's reagenz,dichlorphenol-indophenolnatrium,2,6-dichloroindophenol sodium,unii-kad7q8xo1y,sodium 2,6-dichloroindophenol,sodium 2,6-dichloroindophenolate,2,6-dichloroindophenol, sodium salt PubChem CID: 23697355 ChEBI: CHEBI:948 IUPAC Name: sodium 2,6-dichloro-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzen-1-olate SMILES: [Na+].[O-]C1=C(Cl)C=C(C=C1Cl)N=C1C=CC(=O)C=C1
| PubChem CID | 23697355 |
|---|---|
| CAS | 620-45-1 |
| Molecular Weight (g/mol) | 290.07 |
| ChEBI | CHEBI:948 |
| MDL Number | MFCD00150014 |
| SMILES | [Na+].[O-]C1=C(Cl)C=C(C=C1Cl)N=C1C=CC(=O)C=C1 |
| Synonym | 2,6-dichloroindophenol sodium salt,2,6-dichlorophenolindophenol sodium salt,tillman's reagent,tillman's reagenz,dichlorphenol-indophenolnatrium,2,6-dichloroindophenol sodium,unii-kad7q8xo1y,sodium 2,6-dichloroindophenol,sodium 2,6-dichloroindophenolate,2,6-dichloroindophenol, sodium salt |
| IUPAC Name | sodium 2,6-dichloro-4-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]benzen-1-olate |
| InChI Key | FHLDWQLHDYCXKI-UHFFFAOYSA-M |
| Molecular Formula | C12H6Cl2NNaO2 |
Heptanal 95.0+%, TCI America™
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CAS: 111-71-7 Molecular Formula: C7H14O Molecular Weight (g/mol): 114.19 MDL Number: MFCD00007028 InChI Key: FXHGMKSSBGDXIY-UHFFFAOYSA-N Synonym: heptaldehyde,enanthaldehyde,n-heptaldehyde,enanthal,heptyl aldehyde,heptanaldehyde,n-heptanal,oenanthaldehyde,enanthole,oenanthal PubChem CID: 8130 ChEBI: CHEBI:34787 IUPAC Name: heptanal SMILES: CCCCCCC=O
| PubChem CID | 8130 |
|---|---|
| CAS | 111-71-7 |
| Molecular Weight (g/mol) | 114.19 |
| ChEBI | CHEBI:34787 |
| MDL Number | MFCD00007028 |
| SMILES | CCCCCCC=O |
| Synonym | heptaldehyde,enanthaldehyde,n-heptaldehyde,enanthal,heptyl aldehyde,heptanaldehyde,n-heptanal,oenanthaldehyde,enanthole,oenanthal |
| IUPAC Name | heptanal |
| InChI Key | FXHGMKSSBGDXIY-UHFFFAOYSA-N |
| Molecular Formula | C7H14O |
3-(Dimethylamino)propiophenone Hydrochloride 98.0+%, TCI America™
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CAS: 879-72-1 Molecular Formula: C11H16ClNO Molecular Weight (g/mol): 213.705 MDL Number: MFCD00012481 InChI Key: DKNDBIIKSJWQFL-UHFFFAOYSA-N Synonym: 3-dimethylaminopropiophenone hydrochloride,3-dimethylamino-1-phenylpropan-1-one hydrochloride,3-dimethylamino propiophenone hydrochloride,beta-dimethylaminopropiophenone hydrochloride,1-propanone, 3-dimethylamino-1-phenyl-, hydrochloride,nsc 89,dimethylaminoethylphenylketone hydrochloride,propiophenone, 3-dimethylamino-, hydrochloride,1-propanone, 3-dimethylamino-1-phenyl-, hydrochloride 1:1,wln: 1n1&2vr &gh PubChem CID: 92844 IUPAC Name: 3-(dimethylamino)-1-phenylpropan-1-one;hydrochloride SMILES: CN(C)CCC(=O)C1=CC=CC=C1.Cl
| PubChem CID | 92844 |
|---|---|
| CAS | 879-72-1 |
| Molecular Weight (g/mol) | 213.705 |
| MDL Number | MFCD00012481 |
| SMILES | CN(C)CCC(=O)C1=CC=CC=C1.Cl |
| Synonym | 3-dimethylaminopropiophenone hydrochloride,3-dimethylamino-1-phenylpropan-1-one hydrochloride,3-dimethylamino propiophenone hydrochloride,beta-dimethylaminopropiophenone hydrochloride,1-propanone, 3-dimethylamino-1-phenyl-, hydrochloride,nsc 89,dimethylaminoethylphenylketone hydrochloride,propiophenone, 3-dimethylamino-, hydrochloride,1-propanone, 3-dimethylamino-1-phenyl-, hydrochloride 1:1,wln: 1n1&2vr &gh |
| IUPAC Name | 3-(dimethylamino)-1-phenylpropan-1-one;hydrochloride |
| InChI Key | DKNDBIIKSJWQFL-UHFFFAOYSA-N |
| Molecular Formula | C11H16ClNO |
2-Methylbutyraldehyde 95.0+%, TCI America™
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CAS: 96-17-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00006984 InChI Key: BYGQBDHUGHBGMD-UHFFFAOYNA-N Synonym: 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal PubChem CID: 7284 ChEBI: CHEBI:16182 IUPAC Name: 2-methylbutanal SMILES: CCC(C)C=O
| PubChem CID | 7284 |
|---|---|
| CAS | 96-17-3 |
| Molecular Weight (g/mol) | 86.13 |
| ChEBI | CHEBI:16182 |
| MDL Number | MFCD00006984 |
| SMILES | CCC(C)C=O |
| Synonym | 2-methylbutyraldehyde,butanal, 2-methyl,2-formylbutane,2-methylbutyric aldehyde,methylethylacetaldehyde,2-ethylpropanal,2-methyl-1-butanal,butyraldehyde, 2-methyl,acetaldehyde, ethylmethyl,alpha-methylbutanal |
| IUPAC Name | 2-methylbutanal |
| InChI Key | BYGQBDHUGHBGMD-UHFFFAOYNA-N |
| Molecular Formula | C5H10O |
2'-Chloroacetophenone 97.0+%, TCI America™
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CAS: 2142-68-9 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.593 MDL Number: MFCD00000560 InChI Key: ZDOYHCIRUPHUHN-UHFFFAOYSA-N Synonym: 2'-chloroacetophenone,1-2-chlorophenyl ethanone,o-chloroacetophenone,1-2-chlorophenyl ethan-1-one,ethanone, 1-2-chlorophenyl,acetophenone, 2'-chloro,o-chloroacetophonone,1-2-chloro-phenyl-ethanone,ethanone, 1-chlorophenyl,1-acetyl-2-chlorobenzene PubChem CID: 72864 IUPAC Name: 1-(2-chlorophenyl)ethanone SMILES: CC(=O)C1=CC=CC=C1Cl
| PubChem CID | 72864 |
|---|---|
| CAS | 2142-68-9 |
| Molecular Weight (g/mol) | 154.593 |
| MDL Number | MFCD00000560 |
| SMILES | CC(=O)C1=CC=CC=C1Cl |
| Synonym | 2'-chloroacetophenone,1-2-chlorophenyl ethanone,o-chloroacetophenone,1-2-chlorophenyl ethan-1-one,ethanone, 1-2-chlorophenyl,acetophenone, 2'-chloro,o-chloroacetophonone,1-2-chloro-phenyl-ethanone,ethanone, 1-chlorophenyl,1-acetyl-2-chlorobenzene |
| IUPAC Name | 1-(2-chlorophenyl)ethanone |
| InChI Key | ZDOYHCIRUPHUHN-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |
Ketorolac Tromethamine 98.0+%, TCI America™
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CAS: 74103-07-4 Molecular Formula: C19H24N2O6 Molecular Weight (g/mol): 376.41 MDL Number: MFCD00887595 InChI Key: BWHLPLXXIDYSNW-UHFFFAOYNA-N Synonym: Ketorolac Tris Salt, (+/-)-5-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic Acid Tris Salt PubChem CID: 84003 ChEBI: CHEBI:6130 IUPAC Name: 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid SMILES: NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1
| PubChem CID | 84003 |
|---|---|
| CAS | 74103-07-4 |
| Molecular Weight (g/mol) | 376.41 |
| ChEBI | CHEBI:6130 |
| MDL Number | MFCD00887595 |
| SMILES | NC(CO)(CO)CO.OC(=O)C1CCN2C1=CC=C2C(=O)C1=CC=CC=C1 |
| Synonym | Ketorolac Tris Salt, (+/-)-5-Benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic Acid Tris Salt |
| IUPAC Name | 2-amino-2-(hydroxymethyl)propane-1,3-diol; 5-benzoyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid |
| InChI Key | BWHLPLXXIDYSNW-UHFFFAOYNA-N |
| Molecular Formula | C19H24N2O6 |
1-(4-Chlorophenyl)-4,4,4-trifluoro-1,3-butanedione 98.0+%, TCI America™
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CAS: 18931-60-7 Molecular Formula: C10H6ClF3O2 Molecular Weight (g/mol): 250.60 MDL Number: MFCD00511276 InChI Key: RESLPNKXHQNERF-YVMONPNESA-N PubChem CID: 2773832 IUPAC Name: (3Z)-4-(4-chlorophenyl)-1,1,1-trifluoro-4-hydroxybut-3-en-2-one SMILES: O\C(=C/C(=O)C(F)(F)F)C1=CC=C(Cl)C=C1
| PubChem CID | 2773832 |
|---|---|
| CAS | 18931-60-7 |
| Molecular Weight (g/mol) | 250.60 |
| MDL Number | MFCD00511276 |
| SMILES | O\C(=C/C(=O)C(F)(F)F)C1=CC=C(Cl)C=C1 |
| IUPAC Name | (3Z)-4-(4-chlorophenyl)-1,1,1-trifluoro-4-hydroxybut-3-en-2-one |
| InChI Key | RESLPNKXHQNERF-YVMONPNESA-N |
| Molecular Formula | C10H6ClF3O2 |
2-Oxoglutaric Acid 99.0+%, TCI America™
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CAS: 328-50-7 Molecular Formula: C5H6O5 Molecular Weight (g/mol): 146.098 MDL Number: MFCD00004165 InChI Key: KPGXRSRHYNQIFN-UHFFFAOYSA-N Synonym: 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid PubChem CID: 51 ChEBI: CHEBI:30915 IUPAC Name: 2-oxopentanedioic acid SMILES: C(CC(=O)O)C(=O)C(=O)O
| PubChem CID | 51 |
|---|---|
| CAS | 328-50-7 |
| Molecular Weight (g/mol) | 146.098 |
| ChEBI | CHEBI:30915 |
| MDL Number | MFCD00004165 |
| SMILES | C(CC(=O)O)C(=O)C(=O)O |
| Synonym | 2-ketoglutaric acid,alpha-ketoglutaric acid,2-oxoglutaric acid,2-oxoglutarate,oxoglutaric acid,alpha-ketoglutarate,2-ketoglutarate,alphaketoglutaric acid,alpha-oxoglutaric acid,2-oxo-1,5-pentanedioic acid |
| IUPAC Name | 2-oxopentanedioic acid |
| InChI Key | KPGXRSRHYNQIFN-UHFFFAOYSA-N |
| Molecular Formula | C5H6O5 |
2-tert-Butylanthraquinone 98.0+%, TCI America™
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CAS: 84-47-9 Molecular Formula: C18H16O2 Molecular Weight (g/mol): 264.32 MDL Number: MFCD00001232 InChI Key: YTPSFXZMJKMUJE-UHFFFAOYSA-N Synonym: 2-tert-butylanthraquinone,9,10-anthracenedione, 2-1,1-dimethylethyl,2-tert-butyl-9,10-anthraquinone,2-tert-butyl anthracene-9,10-dione,anthraquinone, 2-tert-butyl,beta-tert-butylanthraquinone,2-t-butylanthraquinone,.beta.-tert-butylanthraquinone,acmc-209puu,2-tert-butyl-anthrachinon PubChem CID: 66532 IUPAC Name: 2-tert-butyl-9,10-dihydroanthracene-9,10-dione SMILES: CC(C)(C)C1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1
| PubChem CID | 66532 |
|---|---|
| CAS | 84-47-9 |
| Molecular Weight (g/mol) | 264.32 |
| MDL Number | MFCD00001232 |
| SMILES | CC(C)(C)C1=CC=C2C(=O)C3=CC=CC=C3C(=O)C2=C1 |
| Synonym | 2-tert-butylanthraquinone,9,10-anthracenedione, 2-1,1-dimethylethyl,2-tert-butyl-9,10-anthraquinone,2-tert-butyl anthracene-9,10-dione,anthraquinone, 2-tert-butyl,beta-tert-butylanthraquinone,2-t-butylanthraquinone,.beta.-tert-butylanthraquinone,acmc-209puu,2-tert-butyl-anthrachinon |
| IUPAC Name | 2-tert-butyl-9,10-dihydroanthracene-9,10-dione |
| InChI Key | YTPSFXZMJKMUJE-UHFFFAOYSA-N |
| Molecular Formula | C18H16O2 |
Nonanal 95.0+%, TCI America™
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CAS: 124-19-6 Molecular Formula: C9H18O Molecular Weight (g/mol): 142.242 MDL Number: MFCD00007030 InChI Key: GYHFUZHODSMOHU-UHFFFAOYSA-N Synonym: pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde PubChem CID: 31289 ChEBI: CHEBI:84268 IUPAC Name: nonanal SMILES: CCCCCCCCC=O
| PubChem CID | 31289 |
|---|---|
| CAS | 124-19-6 |
| Molecular Weight (g/mol) | 142.242 |
| ChEBI | CHEBI:84268 |
| MDL Number | MFCD00007030 |
| SMILES | CCCCCCCCC=O |
| Synonym | pelargonaldehyde,1-nonanal,nonanaldehyde,nonyl aldehyde,n-nonaldehyde,nonylic aldehyde,nonylaldehyde,nonaldehyde,n-nonanal,1-nonaldehyde |
| IUPAC Name | nonanal |
| InChI Key | GYHFUZHODSMOHU-UHFFFAOYSA-N |
| Molecular Formula | C9H18O |