Basic information
- CAS
6152-43-8- Standard SMILES
C[NH+](C)CCOc1ccccc1Cc1ccccc1.[Cl-]- InChIKey
HMBOWANDONYIBI-UHFFFAOYSA-N- Molecular formula
- C17H22ClNO
- Average molar mass
- 291.8 g/mol
- Monoisotopic mass
- 291.138992
Overview
See also: Phenyltoloxamine Hydrochloride (preferred); Phenyltoloxamine (has active moiety).
Names & identifiers
- Preferred name
- (2-(Dimethylamino)ethyl) (o-benzylphenoxy)ether hydrochloride
- IUPAC
- 2-(2-benzylphenoxy)ethyl-dimethylazanium chloride
Names & synonyms
6152-43-8Bristamin hydrochloridephenyltoloxamine HClHL 2153(2-(Dimethylamino)ethyl) (o-benzylphenoxy)ether hydrochlorideN,N-Dimethyl-2-(alpha-phenyl-o-toloxy)-ethylamine hydrochlorideETHYLAMINE, 2-(o-BENZYLPHENOXY)-N,N-DIMETHYL-, HYDROCHLORIDEEthylamine, N,N-dimethyl-2-((alpha-phenyl-o-tolyl)oxy)-, hydrochlorideN-(2'-Dimethylaminoaethyl)-(o-benzylphenol)-aether hydrochlorid [German]N-(2'-Dimethylaminoaethyl)-(o-benzylphenol)-aether hydrochlorid
Database identifiers
- CAS
6152-43-8- PubChem CID
- 22528
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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