trans-8-Methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Basic information
- CAS
101555-40-2- Standard SMILES
COC1=CCCC2CCCCC12- InChIKey
BTLRDSPISZYIIT-UHFFFAOYSA-N- Molecular formula
- C11H18O
- Average molar mass
- 166.26 g/mol
- Monoisotopic mass
- 166.13576519
Names & identifiers
- Preferred name
- trans-8-Methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthalene
- IUPAC
- 8-methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthalene
- English name
- trans-8-Methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthalene
- Molecular formula
- C11H18O
- Molecular weight
- 166.26
Names & synonyms
trans-8-Methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthalene101555-40-28-methoxy-1,2,3,4,4a,5,6,8a-octahydronaphthaleneDTXSID00906311Naphthalene, 1,2,3,4,4a,5,6,8a-octahydro-8-methoxy-, trans- (9CI)
Database identifiers
- CAS
101555-40-2- PubChem CID
- 145369
- DTXSID
DTXSID00906311
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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