Basic information
- CAS
66903-05-7- Standard SMILES
O=C(C[NH+](CCCl)Cc1ccccc1)c1ccccc1.[Cl-]- InChIKey
NHCUKYGKFFMWNQ-UHFFFAOYSA-N- Molecular formula
- C17H19Cl2NO
- Average molar mass
- 324.2 g/mol
- Monoisotopic mass
- 323.0843696
Names & identifiers
- Preferred name
- Benzylamine, N-benzoylmethyl-N-(2-chloroethyl)-, hydrochloride
- IUPAC
- benzyl-(2-chloroethyl)-phenacylazanium chloride
Names & synonyms
BENZYLAMINE, N-BENZOYLMETHYL-N-(2-CHLOROETHYL)-, HYDROCHLORIDE66903-05-7RefChem:1079521N-Benzoylmethyl-N-(2-chloroethyl)benzylamine hydrochloride
Database identifiers
- CAS
66903-05-7- PubChem CID
- 48339
Properties
Computed structural properties
- Topological polar surface area
- 21.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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