Octyl 3-methylbenzoate
octyl 3-methylbenzoate
Also Known As: Octyl 3-methylbenzoate|m-Toluic acid, octyl ester|Octyl 3-methylbenzoate #|m-Toluylic acid, octyl ester
CAS: 67460-70-2
| Molecular Formula | C16H24O2 |
|---|---|
| Molecular Weight | 248.17763 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 248.17763 |
| Monoisotopic Mass | 248.17763 |
| Heavy Atoms | 18 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 67460-70-2 |
|---|---|
| SMILES | CCCCCCCCOC(=O)C1=CC=CC(=C1)C |
| InChIKey | HGEOTNHWCJQOTI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Catalysts (8 patents)
Organic Building Blocks (1 patents)
Polymer Intermediates (31 patents)
Product Overview
Octyl 3-methylbenzoate (CAS 67460-70-2), with molecular formula C16H24O2 and molecular weight 248.17763 g/mol. IUPAC: octyl 3-methylbenzoate.
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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