Basic information
- CAS
15057-50-8- Standard SMILES
C[NH+](C)C(Cc1ccc2c(c1)OCCO2)c1ccccc1.[Cl-]- InChIKey
WPSBBVYUJIHVCZ-UHFFFAOYSA-N- Molecular formula
- C18H22ClNO2
- Average molar mass
- 319.8 g/mol
- Monoisotopic mass
- 319.1339066
Names & identifiers
- Preferred name
- 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N,N-dimethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)
- IUPAC
- [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylethyl]-dimethylazanium chloride
Names & synonyms
15057-50-8DTXSID109339962-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N,N-dimethyl-1-phenylethan-1-amine--hydrogen chloride (1/1)RefChem:1060729DTXCID301362650N,N-Dimethyl-alpha-phenyl-1,4-benzodioxan-6-ethylamine hydrochloride1,4-BENZODIOXAN-6-ETHYLAMINE, N,N-DIMETHYL-alpha-PHENYL-, HYDROCHLORIDE
Database identifiers
- CAS
15057-50-8- PubChem CID
- 27015
Properties
Computed structural properties
- Topological polar surface area
- 22.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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