Basic information
- CAS
63991-07-1- Standard SMILES
CCc1ccc(C[NH+](CC)CCCl)cc1.[Cl-]- InChIKey
HNTNNIBILUQYQT-UHFFFAOYSA-N- Molecular formula
- C13H21Cl2N
- Average molar mass
- 262.22 g/mol
- Monoisotopic mass
- 261.1051051
Names & identifiers
- Preferred name
- Benzylamine, N-(2-chloroethyl)-N,p-diethyl-, hydrochloride
- IUPAC
- 2-chloroethyl-ethyl-[(4-ethylphenyl)methyl]azanium chloride
Names & synonyms
63991-07-1BENZYLAMINE, N-(2-CHLOROETHYL)-N,p-DIETHYL-, HYDROCHLORIDERefChem:10795012-Chloro-N-(p-ethylbenzyl)diethylamine hydrochlorideN-(2-Chloroethyl)-N,4-diethylbenzylamine hydrochlorideDiethylamine, 2-chloro-N-(p-ethylbenzyl)-, hydrochloride
Database identifiers
- CAS
63991-07-1- PubChem CID
- 46226
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 153
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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