3-Methyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1)
Basic information
- CAS
23007-86-5- Standard SMILES
CN1CCC2CC1Cc1ccccc12.Cl- InChIKey
GTILQXXTQIRYGJ-UHFFFAOYSA-N- Molecular formula
- C13H18ClN
- Average molar mass
- 223.74 g/mol
- Monoisotopic mass
- 223.1127773
Names & identifiers
- Preferred name
- 3-Methyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1)
- IUPAC
- 10-methyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrochloride
Names & synonyms
23007-86-5DTXSID509456943-Methyl-1,2,3,4,5,6-hexahydro-2,6-methano-3-benzazocine--hydrogen chloride (1/1)RefChem:1068153DTXCID9013740051,2,3,4,5,6-Hexahydro-3-methyl-2,6-methano-3-benzazocine hydrochloride2-Methyl-6,7-benzomorphan hydrochloride2,6-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3-methyl-, hydrochloride10-methyl-10-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrochloride
Database identifiers
- CAS
23007-86-5- PubChem CID
- 90867
- DTXSID
DTXSID50945694
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 213
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…