CAS Registry Number®
93940-59-1
CAS Name
rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
Molecular Formula
C18H34O2
Molecular Mass
282.46
Other Names and Identifiers
InChI
InChI=1/C18H34O2/c1-5-6-7-8-9-10-18(19)20-17-13-15(4)11-12-16(17)14(2)3/h14-17H,5-13H2,1-4H3/t15-,16+,17-/s2
InChIKey
InChIKey=YBENVMAMNHOPRF-AIKUYTFGNA-N
SMILES
O(C(CCCCCCC)=O)[C@H]1[C@H](C(C)C)CC[C@@H](C)C1
Canonical SMILES
O=C(OC1CC(C)CCC1C(C)C)CCCCCCC
Other Names for this Substance
- Octanoic acid, (1R,2S,5R)-5-ethyl-2-(1-methylethyl)cyclohexyl ester, rel–
- Octanoic acid, 5-methyl-2-(1-methylethyl)cyclohexyl ester, (1α,2β,5α)-
- rel-(1R,2S,5R)-5-Ethyl-2-(1-methylethyl)cyclohexyl octanoate
