2-Butenoic acid, 4-(6-methylheptyl)-2,6-dinitrophenyl ester
[4-(6-methylheptyl)-2,6-dinitrophenyl] but-2-enoate
Also Known As: 4-(6-Methylheptyl)-2,6-dinitrophenyl but-2-enoate|[4-(6-methylheptyl)-2,6-dinitrophenyl] but-2-enoate|2-Butenoic acid, 4-(6-methylheptyl)-2,6-dinitrophenyl ester|[4-(6-methylheptyl)-2,6-dinitro-phenyl] But-2-enoate
CAS: 890090-91-2
| Molecular Formula | C18H24N2O6 |
|---|---|
| Molecular Weight | 364.16342 g/mol |
| LogP | 4.7434 |
| Topological Polar Surface Area | 112.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 364.16342 |
| Monoisotopic Mass | 364.16342 |
| Heavy Atoms | 26 |
| Complexity | 661.9169 |
Chemical Identifiers
| CAS Number | 890090-91-2 |
|---|---|
| SMILES | CC=CC(=O)OC1=C(C=C(C=C1[N+](=O)[O-])CCCCCC(C)C)[N+](=O)[O-] |
Product Overview
2-Butenoic acid, 4-(6-methylheptyl)-2,6-dinitrophenyl ester (CAS 890090-91-2), with molecular formula C18H24N2O6 and molecular weight 364.16342 g/mol. IUPAC: [4-(6-methylheptyl)-2,6-dinitrophenyl] but-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.
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2-Butenoic acid, 4-(6-methylheptyl)-2,6-dinitrophenyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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