Basic information
- CAS
56485-61-1- Standard SMILES
CC1([NH3+])CCCc2ccccc2C1.[Cl-]- InChIKey
HJOPRBLZBUMUEM-UHFFFAOYSA-N- Molecular formula
- C12H18ClN
- Average molar mass
- 211.73 g/mol
- Monoisotopic mass
- 211.1127773
Names & identifiers
- Preferred name
- 5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-6-methyl-, hydrochloride, (+-)-
- IUPAC
- (6-methyl-5,7,8,9-tetrahydrobenzo[7]annulen-6-yl)azanium chloride
Names & synonyms
(+-)-6,7,8,9-Tetrahydro-6-methyl-5H-benzocyclohepten-6-amine hydrochloride56485-61-1(+-)-6-Amino-6-methyl-6,7,8,9-tetrahydro-5H-benzocycloheptene hydrochloride5H-BENZOCYCLOHEPTEN-6-AMINE, 6,7,8,9-TETRAHYDRO-6-METHYL-, HYDROCHLORIDE, (+-)-RefChem:305325
Database identifiers
- CAS
56485-61-1- PubChem CID
- 41901
Properties
Computed structural properties
- Topological polar surface area
- 27.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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