8-Chloro-N,N-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine--hydrogen chloride (1/1)
Basic information
- CAS
37483-75-3- Standard SMILES
C[NH+](C)C1CCCOc2cc(Cl)ccc21.[Cl-]- InChIKey
MFLAHPSPNNNXQE-UHFFFAOYSA-N- Molecular formula
- C12H17Cl2NO
- Average molar mass
- 262.17 g/mol
- Monoisotopic mass
- 261.0687196
Names & identifiers
- Preferred name
- 8-Chloro-N,N-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine--hydrogen chloride (1/1)
- IUPAC
- (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-dimethylazanium chloride
Names & synonyms
37483-75-3DTXSID709585848-Chloro-N,N-dimethyl-2,3,4,5-tetrahydro-1-benzoxepin-5-amine--hydrogen chloride (1/1)RefChem:1074684DTXCID2013864875-Diethylamino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride2,3,4,5-Tetrahydro-8-chloro-N,N-dimethyl-1-benzoxepin-5-amine hydrochloride1-BENZOXEPIN-5-AMINE, 2,3,4,5-TETRAHYDRO-8-CHLORO-N,N-DIMETHYL-, HYDROCHLORIDE
Database identifiers
- CAS
37483-75-3- PubChem CID
- 37758
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 210
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Compound notes
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