Isopropyl 3,5,5-trimethylhexanoate
propan-2-yl 3,5,5-trimethylhexanoate
Also Known As: Isopropyl 3,5,5-trimethylhexanoate|propan-2-yl 3,5,5-trimethylhexanoate|EINECS 258-563-5|3,5,5-Trimethylhexanoic acid 1-methylethyl ester|Hexanoic acid, 3,5,5-trimethyl-, isopropyl ester|Hexanoic acid,3,5,5-trimethyl-, 1-methylethyl ester
| Molecular Formula | C12H24O2 |
|---|---|
| Molecular Weight | 200.17763 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 200.17763 |
| Heavy Atoms | 14 |
| Complexity | 177.3 |
Chemical Identifiers
| CAS Number | 53451-16-4 |
|---|---|
| SMILES | CC(C)OC(=O)CC(C)CC(C)(C)C |
Product Overview
Isopropyl 3,5,5-trimethylhexanoate (CAS 53451-16-4), with molecular formula C12H24O2 and molecular weight 200.17763 g/mol. IUPAC: propan-2-yl 3,5,5-trimethylhexanoate.
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