Basic information
- CAS
66903-08-0- Standard SMILES
CCCC[NH+](CCCl)Cc1ccccc1.[Cl-]- InChIKey
KOVRGMHDBWJQTD-UHFFFAOYSA-N- Molecular formula
- C13H21Cl2N
- Average molar mass
- 262.22 g/mol
- Monoisotopic mass
- 261.1051051
Names & identifiers
- Preferred name
- Benzylamine, N-butyl-N-(2-chloroethyl)-, hydrochloride
- IUPAC
- benzyl-butyl-(2-chloroethyl)azanium chloride
Names & synonyms
BENZYLAMINE, N-BUTYL-N-(2-CHLOROETHYL)-, HYDROCHLORIDE66903-08-0RefChem:1079522N-Butyl-N-(2-chloroethyl)benzylamine hydrochloride
Database identifiers
- CAS
66903-08-0- PubChem CID
- 48345
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 143
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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