Basic information
- CAS
67031-39-4- Standard SMILES
COc1ccccc1C(O)C(C)[NH3+].[Cl-]- InChIKey
WVPUJLUJFADKPL-UHFFFAOYSA-N- Molecular formula
- C10H16ClNO2
- Average molar mass
- 217.69 g/mol
- Monoisotopic mass
- 217.0869564
Names & identifiers
- Preferred name
- Benzyl alcohol, alpha-(1-aminoethyl)-2-methoxy-, hydrochloride
- IUPAC
- [1-hydroxy-1-(2-methoxyphenyl)propan-2-yl]azanium chloride
Names & synonyms
BENZYL ALCOHOL, alpha-(1-AMINOETHYL)-2-METHOXY-, HYDROCHLORIDE67031-39-4RefChem:1079441alpha-(1-Aminoethyl)-2-methoxybenzyl alcohol hydrochloride
Database identifiers
- CAS
67031-39-4- PubChem CID
- 48894
Properties
Computed structural properties
- Topological polar surface area
- 57.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 152
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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