3-(6,11-Dihydro-5H-dibenzo[b,e]azepin-11-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
Basic information
- CAS
966-90-5- Standard SMILES
CN(C)CCCC1c2ccccc2CNc2ccccc21.Cl- InChIKey
CREKMSNCLQCMKK-UHFFFAOYSA-N- Molecular formula
- C19H25ClN2
- Average molar mass
- 316.9 g/mol
- Monoisotopic mass
- 316.1706265
Names & identifiers
- Preferred name
- 3-(6,11-Dihydro-5H-dibenzo[b,e]azepin-11-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
- IUPAC
- 3-(6,11-dihydro-5H-benzo[c][1]benzazepin-11-yl)-N,N-dimethylpropan-1-amine;hydrochloride
Names & synonyms
DTXSID009144313-(6,11-Dihydro-5H-dibenzo[b,e]azepin-11-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
966-90-5- PubChem CID
- 70407
- DTXSID
DTXSID00914431
Properties
Computed structural properties
- Topological polar surface area
- 15.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 315
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Compound notes
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