Methyl 4-(octylamino)-4-oxobut-2-enoate
methyl 4-(octylamino)-4-oxobut-2-enoate
Also Known As: METHYL (Z)-3-(OCTYLCARBAMOYL)PROP-2-ENOATE|2-Butenoic acid, 4-(octylamino)-4-oxo-, methyl ester, (Z)-
CAS: 96775-68-7
| Molecular Formula | C13H23NO3 |
|---|---|
| Molecular Weight | 241.1678 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 241.1678 |
| Monoisotopic Mass | 241.1678 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 96775-68-7 |
|---|---|
| SMILES | CCCCCCCCNC(=O)C=CC(=O)OC |
| InChIKey | YFYLRPBKNXFGQQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Plastic Additives (3 patents)
Product Overview
Methyl 4-(octylamino)-4-oxobut-2-enoate (CAS 96775-68-7), with molecular formula C13H23NO3 and molecular weight 241.1678 g/mol. IUPAC: methyl 4-(octylamino)-4-oxobut-2-enoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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