2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride
Basic information
- CAS
63977-49-1- Standard SMILES
C[N+](C)(CCCl)CCCl.[Cl-]- InChIKey
MGFVNWXRFBPCJJ-UHFFFAOYSA-M- Molecular formula
- C6H14Cl3N
- Average molar mass
- 206.5 g/mol
- Monoisotopic mass
- 205.019183
Names & identifiers
- Preferred name
- 2-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chloride
- IUPAC
- bis(2-chloroethyl)-dimethylazanium chloride
Names & synonyms
DTXSID309814142-Chloro-N-(2-chloroethyl)-N,N-dimethylethan-1-aminium chlorideRefChem:1062811DTXCID10140868663977-49-1Bis(2-chloroethyl)dimethylammonium chlorideTL 379Dimethyl-bis(beta-chloroethyl)ammonium chlorideAMMONIUM, BIS(2-CHLOROETHYL)DIMETHYL-, CHLORIDEEthanaminium, 2-chloro-N-(2-chloroethyl)-N,N-dimethyl-, chlorideSCHEMBL7459400NSC41580
Show more names
NSC 41580NSC-415802-CHLORO-N-(2-CHLOROETHYL)-N, CHLORIDE
Database identifiers
- CAS
63977-49-1- PubChem CID
- 45790
- DTXSID
DTXSID30981414
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 65.5
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Compound notes
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