methyl [(8aR*)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]acetate
Chemical Structure Depiction of
methyl [(8aR*)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]acetate
methyl [(8aR*)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]acetate
Compound characteristics
Compound ID: | 0350-0113 |
Compound Name: | methyl [(8aR*)-2,5,5,8a-tetramethyl-3-oxo-3,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]acetate |
Molecular Weight: | 278.39 |
Molecular Formula: | C17 H26 O3 |
Smiles: | CC1=C(CC(=O)OC)[C@@]2(C)CCC[C@](C)(C)C2CC1=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 3.1697 |
logD: | 3.1697 |
logSw: | -3.4389 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 34.178 |
InChI Key: | YTAQULCZDXWXPY-FBMWCMRBSA-N |