Basic information
- CAS
20809-02-3- Standard SMILES
CCC(O)c1ccccc1OCC[NH+](C)C.[Cl-]- InChIKey
WWFSMXXSMREMIJ-UHFFFAOYSA-N- Molecular formula
- C13H22ClNO2
- Average molar mass
- 259.77 g/mol
- Monoisotopic mass
- 259.1339066
Names & identifiers
- Preferred name
- Benzyl alcohol, 2-(2-(dimethylamino)ethoxy)-alpha-ethyl-, hydrochloride
- IUPAC
- 2-[2-(1-hydroxypropyl)phenoxy]ethyl-dimethylazanium chloride
Names & synonyms
BENZYL ALCOHOL, 2-(2-(DIMETHYLAMINO)ETHOXY)-alpha-ETHYL-, HYDROCHLORIDE20809-02-3Benzenemethanol, 2-(2-(dimethylamino)ethoxy)-alpha-ethyl-, hydrochlorideBenzyl alcohol, 6-(2-(dimethylamino)ethoxy)-alpha-ethyl-, hydrochloride2-(alpha-Hydroxypropyl)-beta-(N,N-dimethyl)phenoxyethylamine, hydrochlorideRefChem:328542
Database identifiers
- CAS
20809-02-3- PubChem CID
- 30280
Properties
Computed structural properties
- Topological polar surface area
- 33.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 185
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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