4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
Basic information
- CAS
55332-02-0- Standard SMILES
CC(C)C1CC(=O)C2CCCC(C)C2(C)C1- InChIKey
XWJOSENQVBWBGM-UHFFFAOYSA-N- Molecular formula
- C15H26O
- Average molar mass
- 222.37 g/mol
- Monoisotopic mass
- 222.19836545
Names & identifiers
- Preferred name
- 4a,5-Dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
- IUPAC
- 4a,5-dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one
Names & synonyms
4a,5-dimethyl-3-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-one55332-02-0DTXSID609706794a,5-Dimethyl-3-(propan-2-yl)octahydronaphthalen-1(2H)-one
Database identifiers
- CAS
55332-02-0- PubChem CID
- 41426
- DTXSID
DTXSID60970679- Nikkaji
- J1.842.725G
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
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…