Basic information
- CAS
63990-98-7- Standard SMILES
CCCNC(C)C(O)c1ccccc1.Cl- InChIKey
NYGBABLOVPPBIK-UHFFFAOYSA-N- Molecular formula
- C12H20ClNO
- Average molar mass
- 229.74 g/mol
- Monoisotopic mass
- 229.123342
Overview
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Names & identifiers
- Preferred name
- 1-Phenyl-2-(propylamino)propan-1-ol
- IUPAC
- 1-phenyl-2-(propylamino)propan-1-ol;hydrochloride
Names & synonyms
1-phenyl-2-(propylamino)propan-1-olalpha-(1-Propylaminoethyl)-benzyl alcohol, hydrochloride
Database identifiers
- CAS
63990-98-7- PubChem CID
- 458447
- DTXSID
DTXSID70981796
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 3
- 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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