N,N-Bis(2-chloroethyl)-1-naphthalenemethylamine, hydrochloride
Basic information
- CAS
60855-84-7- Standard SMILES
Cl.ClCCN(CCCl)Cc1cccc2ccccc12- InChIKey
JDWWUVHHDKKJCR-UHFFFAOYSA-N- Molecular formula
- C15H18Cl3N
- Average molar mass
- 318.7 g/mol
- Monoisotopic mass
- 317.050483
Overview
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Names & identifiers
- Preferred name
- N,N-Bis(2-chloroethyl)-1-naphthalenemethylamine, hydrochloride
- IUPAC
- 2-chloro-N-(2-chloroethyl)-N-(naphthalen-1-ylmethyl)ethanamine;hydrochloride
Names & synonyms
DTXSID90976326NSC172650NSC-1726502-chloro-N-(2-chloroethyl)-N-(1-naphthylmethyl)ethanamineN,N-Bis(2-chloroethyl)-1-naphthalenemethylamine, hydrochloride2-Chloro-N-(2-chloroethyl)-N-[(naphthalen-1-yl)methyl]ethan-1-amine--hydrogen chloride (1/1)
Database identifiers
- CAS
60855-84-7- PubChem CID
- 458442
- DTXSID
DTXSID90976326
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 229
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