Basic information
- CAS
67195-48-6- Standard SMILES
CC[NH+](CCCl)CCCCl.[Cl-]- InChIKey
YXEDGTLWOUMDCX-UHFFFAOYSA-N- Molecular formula
- C7H16Cl3N
- Average molar mass
- 220.6 g/mol
- Monoisotopic mass
- 219.034833
Names & identifiers
- Preferred name
- 3-Chloro-N-(2-chloroethyl)-N-ethylpropan-1-amine--hydrogen chloride (1/1)
- IUPAC
- 2-chloroethyl-(3-chloropropyl)-ethylazanium chloride
Names & synonyms
DTXSID209862313-Chloro-N-(2-chloroethyl)-N-ethylpropan-1-amine--hydrogen chloride (1/1)RefChem:1067611DTXCID201413416Ethyl(2-chloroethyl) (3-chloropropyl)amine hydrochlorideDIETHYLAMINE, 2-CHLORO-N-(3-CHLOROPROPYL)-, HYDROCHLORIDEPropylamine, 3-chloro-N-(2-chloroethyl)-N-ethyl-, hydrochlorideNSC 400721
Database identifiers
- CAS
67195-48-6- PubChem CID
- 49440
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 68.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…