2,2,4-Trimethyl-3-pentenal
2,2,4-trimethylpent-3-enal
Also Known As: 2,2,4-trimethylpent-3-enal|2,2,4-Trimethyl-3-pentenal|3-Pentenal, 2,2,4-trimethyl-|NCIOpen2_001303|3-Pentenal,2,2,4-trimethyl-|2,2,4-Trimethyl-pent-3-enal
CAS: 58877-89-7
| Molecular Formula | C8H14O |
|---|---|
| Molecular Weight | 126.10446 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.10446 |
| Monoisotopic Mass | 126.10446 |
| Heavy Atoms | 9 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 58877-89-7 |
|---|---|
| SMILES | CC(=CC(C)(C)C=O)C |
| InChIKey | QJJLGDXUAXOUBP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Plastic Additives (1 patents)
Product Overview
2,2,4-Trimethyl-3-pentenal (CAS 58877-89-7), with molecular formula C8H14O and molecular weight 126.10446 g/mol. IUPAC: 2,2,4-trimethylpent-3-enal.
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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