Basic information
- CAS
51490-43-8- Standard SMILES
[Cl-].[NH3+]C(c1ccccc1)c1ccc2c(c1)CCCCC2- InChIKey
CBGFJSCBSZUFPB-UHFFFAOYSA-N- Molecular formula
- C18H22ClN
- Average molar mass
- 287.8 g/mol
- Monoisotopic mass
- 287.1440774
Names & identifiers
- Preferred name
- 5H-Benzocycloheptene-2-methanamine, 6,7,8,9-tetrahydro-alpha-phenyl-, hydrochloride
- IUPAC
- [phenyl(6,7,8,9-tetrahydro-5H-benzo[7]annulen-3-yl)methyl]azanium chloride
Names & synonyms
51490-43-8alpha-(6,7,8,9-Tetrahydro-5H-benzocyclohepten-2-yl)benzylamine hydrochloride5H-Benzocycloheptene-2-methanamine, 6,7,8,9-tetrahydro-alpha-phenyl-, hydrochloride6,7,8,9-Tetrahydro-alpha-phenyl-5H-benzocycloheptene-2-methanamine hydrochlorideRefChem:305360
Database identifiers
- CAS
51490-43-8- PubChem CID
- 40035
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 269
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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