Basic information
- CAS
97802-27-2- Standard SMILES
CCCN1CCC[C@H]2c3ccccc3CC[C@H]21- InChIKey
RAHVGYXWVDTURX-JKSUJKDBSA-N- Molecular formula
- C16H23N
- Average molar mass
- 229.36 g/mol
- Monoisotopic mass
- 229.18304974
Names & identifiers
- Preferred name
- Benzo(f)quinoline, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, cis-
- IUPAC
- (4aR,10bS)-4-propyl-2,3,4a,5,6,10b-hexahydro-1H-benzo[f]quinoline
Names & synonyms
Benzo(f)quinoline, 1,2,3,4,4a,5,6,10b-octahydro-4-propyl-, cis-97802-27-2cis-4-n-Propyloctahydrobenzo(f)quinolineDTXSID80243251(4aR,10bS)-4-Propyl-1,2,3,4,4a,5,6,10b-octahydrobenzo[f]quinoline
Database identifiers
- CAS
97802-27-2- PubChem CID
- 178986
- DTXSID
DTXSID80243251- Nikkaji
- J397.481B
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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