Basic information
- CAS
6332-28-1- Standard SMILES
[Cl-].c1ccc(CC[NH2+]CCc2ccccc2)cc1- InChIKey
GBMYHLWTKLNQKD-UHFFFAOYSA-N- Molecular formula
- C16H20ClN
- Average molar mass
- 261.79 g/mol
- Monoisotopic mass
- 261.1284273
Overview
See also: Bis(2-phenylethyl)amine hydrochloride (preferred).
Names & identifiers
- Preferred name
- Diphenethylamine, hydrochloride
- IUPAC
- bis(2-phenylethyl)azanium chloride
Names & synonyms
DIPHENETHYLAMINE, HYDROCHLORIDEN,N-bis(2-phenylethyl)amine hydrochlorideNSC 27304Di-(beta-phenylethyl)amine hydrochlorideBenzeneethanamine, N-(2-phenylethyl)-, hydrochloridebis(2-phenylethyl)azanium;chloride
Database identifiers
- CAS
6332-28-1- PubChem CID
- 22790
Properties
Computed structural properties
- Topological polar surface area
- 16.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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