3-Methyl-1,2,3,4,5,6-hexahydro-1,5-methano-3-benzazocine--hydrogen chloride (1/1)
Basic information
- CAS
36065-74-4- Standard SMILES
CN1CC2Cc3ccccc3C(C2)C1.Cl- InChIKey
SVQUZUXZCOUZDP-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-1,5-methano-3-benzazocine--hydrogen chloride (1/1)
- IUPAC
- 11-methyl-11-azatricyclo[7.3.1.02,7]trideca-2,4,6-triene;hydrochloride
Names & synonyms
36065-74-4DTXSID309574773-Methyl-1,2,3,4,5,6-hexahydro-1,5-methano-3-benzazocine--hydrogen chloride (1/1)RefChem:1068151DTXCID5013854141,2,3,4,5,6-Hexahydro-3-methyl-1,5-methano-3-benzazocine hydrochloride1,5-Methano-3-benzazocine, 1,2,3,4,5,6-hexahydro-3-methyl-, hydrochloride
Database identifiers
- CAS
36065-74-4- PubChem CID
- 215682
- DTXSID
DTXSID30957477
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
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