Basic information
- CAS
13371-56-7- Standard SMILES
CC(Cc1ccccc1)NCc1ccc(Cl)cc1.Cl- InChIKey
KWJUCCFQFMTJDF-UHFFFAOYSA-N- Molecular formula
- C16H19Cl2N
- Average molar mass
- 296.2 g/mol
- Monoisotopic mass
- 295.089455
Names & identifiers
- Preferred name
- Phenethylamine, N-(p-chlorobenzyl)-alpha-methyl-, hydrochloride, (+)-
- IUPAC
- N-[(4-chlorophenyl)methyl]-1-phenylpropan-2-amine;hydrochloride
Names & synonyms
(+)-N-(p-Chlorobenzyl)-alpha-methylphenethylamine hydrochloride13371-56-7Phenethylamine, N-(p-chlorobenzyl)-alpha-methyl-, hydrochloride, (+)-RefChem:368756DTXSID30928248N-[(4-Chlorophenyl)methyl]-1-phenylpropan-2-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
13371-56-7- PubChem CID
- 202811
- DTXSID
DTXSID30928248
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 217
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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