Basic information
- CAS
17408-66-1- Standard SMILES
CC(C)C1CCC2(C)C=CC(=O)CC2(C)C1- InChIKey
ZAASYBLGJDURHX-UHFFFAOYSA-N- Molecular formula
- C15H24O
- Average molar mass
- 220.35 g/mol
- Monoisotopic mass
- 220.18271539
Names & identifiers
- Preferred name
- 2(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7alpha-isopropyl-4abeta,8abeta-dimethyl-
- IUPAC
- 4a,8a-dimethyl-7-propan-2-yl-5,6,7,8-tetrahydro-1H-naphthalen-2-one
Names & synonyms
DTXSID308807112(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7.alpha.-isopropyl-4a.beta.,8a.beta.-dimethyl-17408-66-12(1H)-Naphthalenone, 4a,5,6,7,8,8a-hexahydro-7alpha-isopropyl-4abeta,8abeta-dimethyl-RefChem:241207DTXCID501022074ZAASYBLGJDURHX-UHFFFAOYSA-NNS000961164a,8a-Dimethyl-7-(propan-2-yl)-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one7-Isopropyl-4a,8a-dimethyl-4a,5,6,7,8,8a-hexahydro-2(1H)-naphthalenone #
Database identifiers
- CAS
17408-66-1- PubChem CID
- 549685
- DTXSID
DTXSID30880711
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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