Basic information
- Standard SMILES
CCCCCCCCc1ccc2c(c1)CCNCC2- InChIKey
GYJVGGCZQUFARV-UHFFFAOYSA-N- Molecular formula
- C18H29N
- Average molar mass
- 259.4 g/mol
Names & identifiers
- Preferred name
- 7-Octyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine
- IUPAC
- 7-octyl-2,3,4,5-tetrahydro-1H-3-benzazepine
Names & synonyms
SCHEMBL566352GYJVGGCZQUFARV-UHFFFAOYSA-N7-Octyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine
Database identifiers
- PubChem CID
- 66726752
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 226
Related reactions
1 records
Compound notes
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