Benzyl alcohol, m-methyl-alpha-(1-aminoethyl)-, hydrochloride
Basic information
- CAS
63991-27-5- Standard SMILES
Cc1cccc(C(O)C(C)[NH3+])c1.[Cl-]- InChIKey
BPPMPRBFXKFHSD-UHFFFAOYSA-N- Molecular formula
- C10H16ClNO
- Average molar mass
- 201.69 g/mol
- Monoisotopic mass
- 201.0920418
Names & identifiers
- Preferred name
- Benzyl alcohol, m-methyl-alpha-(1-aminoethyl)-, hydrochloride
- IUPAC
- [1-hydroxy-1-(3-methylphenyl)propan-2-yl]azanium chloride
Names & synonyms
63991-27-5BENZYL ALCOHOL, m-METHYL-alpha-(1-AMINOETHYL)-, HYDROCHLORIDERefChem:10794571-Propanol, 1-(m-tolyl)-2-amino-, hydrochloride
Database identifiers
- CAS
63991-27-5- PubChem CID
- 46257
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 138
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Compound notes
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