Basic information
- CAS
37483-69-5- Standard SMILES
[Cl-].[NH3+]C1CCCOc2cc(Cl)ccc21- InChIKey
ZRAQEMHFRRTQPF-UHFFFAOYSA-N- Molecular formula
- C10H13Cl2NO
- Average molar mass
- 234.12 g/mol
- Monoisotopic mass
- 233.0374194
Overview
See other relationships...
Names & identifiers
- Preferred name
- 5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride
- IUPAC
- (8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)azanium chloride
Names & synonyms
5-Amino-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride2,3,4,5-Tetrahydro-8-chloro-1-benzoxepin-5-amine hydrochloride1-BENZOXEPIN-5-AMINE, 2,3,4,5-TETRAHYDRO-8-CHLORO-, HYDROCHLORIDE
Database identifiers
- CAS
37483-69-5- PubChem CID
- 37754
Properties
Computed structural properties
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…