(4aRS)-3,4-bis(bromomethyl)-4a,8,8-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one
Chemical Structure Depiction of
(4aRS)-3,4-bis(bromomethyl)-4a,8,8-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one
(4aRS)-3,4-bis(bromomethyl)-4a,8,8-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one
Compound characteristics
| Compound ID: | 8006-2550 |
| Compound Name: | (4aRS)-3,4-bis(bromomethyl)-4a,8,8-trimethyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one |
| Molecular Weight: | 378.14 |
| Molecular Formula: | C15 H22 Br2 O |
| Smiles: | CC1(C)CCC[C@@]2(C)C1CC(C(C[Br])=C2C[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5338 |
| logD: | 4.5338 |
| logSw: | -4.3873 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 13.599 |
| InChI Key: | DMTHIPXSMWHVAP-AWKYBWMHSA-N |