5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-N,6-dimethyl-, hydrochloride, (+-)-
Basic information
- CAS
56485-63-3- Standard SMILES
C[NH2+]C1(C)CCCc2ccccc2C1.[Cl-]- InChIKey
QOGIJCPNYREKSD-UHFFFAOYSA-N- Molecular formula
- C13H20ClN
- Average molar mass
- 225.76 g/mol
- Monoisotopic mass
- 225.1284273
Names & identifiers
- Preferred name
- 5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-N,6-dimethyl-, hydrochloride, (+-)-
- IUPAC
- methyl-(6-methyl-5,7,8,9-tetrahydrobenzo[7]annulen-6-yl)azanium chloride
Names & synonyms
56485-63-3(+-)-6-Methylamino-6-methyl-6,7,8,9-tetrahydro-5H-benzocycloheptene hydrochloride(+-)-6,7,8,9-Tetrahydro-N,6-dimethyl-5H-benzocyclohepten-6-amine hydrochloride5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-N,6-dimethyl-, hydrochloride, (+-)-RefChem:305326
Database identifiers
- CAS
56485-63-3- PubChem CID
- 41903
Properties
Computed structural properties
- Topological polar surface area
- 16.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 190
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…