Basic information
- CAS
65673-87-2- Standard SMILES
c1ccc(CN2c3ccccc3[C@H]3CCCC[C@H]32)cc1- InChIKey
ARHPUJZOEOQTLT-IEBWSBKVSA-N- Molecular formula
- C19H21N
- Average molar mass
- 263.4 g/mol
- Monoisotopic mass
- 263.16739967
Names & identifiers
- Preferred name
- (4aR,9aR)-9-Benzyl-2,3,4,4a,9,9a-hexahydro-1H-carbazole
- IUPAC
- (4aR,9aR)-9-benzyl-1,2,3,4,4a,9a-hexahydrocarbazole
Names & synonyms
65673-87-2DTXSID30495228(4aR,9aR)-9-Benzyl-2,3,4,4a,9,9a-hexahydro-1H-carbazole
Database identifiers
- CAS
65673-87-2- PubChem CID
- 12377794
- DTXSID
DTXSID30495228
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 320
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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