Basic information
- CAS
100427-82-5- Standard SMILES
CCN(CCCl)Cc1ccc(Cl)cc1- InChIKey
DQVHBIDSEFMVEU-UHFFFAOYSA-N- Molecular formula
- C11H15Cl2N
- Average molar mass
- 232.15 g/mol
- Monoisotopic mass
- 231.0581549
Names & identifiers
- Preferred name
- Benzylamine, p-chloro-N-(2-chloroethyl)-N-ethyl-
- IUPAC
- 2-chloro-N-[(4-chlorophenyl)methyl]-N-ethylethanamine
Names & synonyms
BRN 2693280BENZYLAMINE, p-CHLORO-N-(2-CHLOROETHYL)-N-ETHYL-p-Chloro-N-(2-chloroethyl)-N-ethylbenzylamine100427-82-5RefChem:328841DTXSID60905481AKOS0126935672-Chloro-N-[(4-chlorophenyl)methyl]-N-ethylethan-1-amine
Database identifiers
- CAS
100427-82-5- PubChem CID
- 46223
- DTXSID
DTXSID60905481- Nikkaji
- J69.055D
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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