Ethanamine, 2-((8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy)-N,N-dimethyl-, hydrochloride
Basic information
- CAS
37483-63-9- Standard SMILES
CN(C)CCOC1CCCOc2cc(Cl)ccc21.Cl- InChIKey
PHVPKIMJXKRAQO-UHFFFAOYSA-N- Molecular formula
- C14H21Cl2NO2
- Average molar mass
- 306.2 g/mol
- Monoisotopic mass
- 305.0949343
Names & identifiers
- Preferred name
- Ethanamine, 2-((8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy)-N,N-dimethyl-, hydrochloride
- IUPAC
- 2-[(8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy]-N,N-dimethylethanamine;hydrochloride
Names & synonyms
5-(2-Dimethylaminoethoxy)-8-chloro-2,3,4,5-tetrahydro-1-benzoxepin hydrochloride37483-63-92-((8-Chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy)-N,N-dimethylethanamine hydrochlorideEthanamine, 2-((8-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy)-N,N-dimethyl-, hydrochlorideRefChem:339815DTXSID909585812-[(8-Chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)oxy]-N,N-dimethylethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
37483-63-9- PubChem CID
- 216602
- DTXSID
DTXSID90958581
Properties
Computed structural properties
- Topological polar surface area
- 21.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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