3-Methylbut-3-enyl benzoate
3-methylbut-3-enyl benzoate
Also Known As: 3-methylbut-3-enyl benzoate|3-Methyl-3-butenyl benzoate|3-methylbut-3-en-1-yl benzoate|3-METHYLBUT-3-ENYLBENZOATE|3-Buten-1-ol, 3-methyl-, benzoate|3-Methyl-3-buten-1-yl benzoate|3-methylbut-3-en-1-ylbenzoate|3-Buten-1-ol, 3-methyl-, 1-benzoate|benzoic acid 3-methylbut-3-enyl ester|Benzoic acid 3-methyl-3-butenyl ester
CAS: 5205-12-9
| Molecular Formula | C12H14O2 |
|---|---|
| Molecular Weight | 190.09938 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 190.09938 |
| Monoisotopic Mass | 190.09938 |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 5205-12-9 |
|---|---|
| SMILES | CC(=C)CCOC(=O)C1=CC=CC=C1 |
| InChIKey | BBTRQSDRTFFNSW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Organic Building Blocks (2 patents)
Polymer Intermediates (5 patents)
Product Overview
3-Methylbut-3-enyl benzoate (CAS 5205-12-9), with molecular formula C12H14O2 and molecular weight 190.09938 g/mol. IUPAC: 3-methylbut-3-enyl benzoate.
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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