Methyl 2-ethylheptanoate
methyl 2-ethylheptanoate
Also Known As: Methyl 2-ethylheptanoate|Methyl 2-ethyl heptanoate|Methyl 2-ethylheptanoic acid|2-Ethylheptanoicacidmethylester|Heptanoic acid, 2-ethyl-, methyl ester|2-Ethylheptanoic acid methyl ester
CAS: 816-63-7
| Molecular Formula | C10H20O2 |
|---|---|
| Molecular Weight | 172.14633 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.14633 |
| Monoisotopic Mass | 172.14633 |
| Heavy Atoms | 12 |
| Complexity | 121.0 |
Chemical Identifiers
| CAS Number | 816-63-7 |
|---|---|
| SMILES | CCCCCC(CC)C(=O)OC |
| InChIKey | OSHQMJZDFYTFRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Catalysts (4 patents)
Heterocyclic Building Blocks (5 patents)
Organic Building Blocks (15 patents)
Pharmaceutical Intermediates (3 patents)
Surfactants & Detergents (3 patents)
Product Overview
Methyl 2-ethylheptanoate (CAS 816-63-7), with molecular formula C10H20O2 and molecular weight 172.14633 g/mol. IUPAC: methyl 2-ethylheptanoate.
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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