Basic information
- CAS
63990-98-7- Standard SMILES
CCC[NH2+]C(C)C(O)c1ccccc1.[Cl-]- InChIKey
NYGBABLOVPPBIK-UHFFFAOYSA-N- Molecular formula
- C12H20ClNO
- Average molar mass
- 229.74 g/mol
- Monoisotopic mass
- 229.123342
Names & identifiers
- Preferred name
- 1-Phenyl-2-(propylamino)propan-1-ol--hydrogen chloride (1/1)
- IUPAC
- (1-hydroxy-1-phenylpropan-2-yl)-propylazanium chloride
Names & synonyms
63990-98-7DTXSID709817961-Phenyl-2-(propylamino)propan-1-ol--hydrogen chloride (1/1)RefChem:1056301DTXCID601409065(+-)-alpha-(1-(n-Propylamino)ethyl)benzyl alcohol hydrochlorideBENZYL ALCOHOL, alpha-(1-(n-PROPYLAMINO)ETHYL)-, HYDROCHLORIDE, (+-)-
Database identifiers
- CAS
63990-98-7- PubChem CID
- 46215
Properties
Computed structural properties
- Topological polar surface area
- 36.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 143
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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