Basic information
- CAS
5447-94-9- Standard SMILES
CCOCC[N+]([O-])(CCCl)CCCl.Cl- InChIKey
OLLJRQVLWRYCOO-UHFFFAOYSA-N- Molecular formula
- C8H18Cl3NO2
- Average molar mass
- 266.6 g/mol
- Monoisotopic mass
- 265.040312
Names & identifiers
- Preferred name
- Triethylamine, 2,2'-dichloro-2''-ethoxy-, N-oxide, hydrochloride
- IUPAC
- N,N-bis(2-chloroethyl)-2-ethoxyethanamine oxide;hydrochloride
Database identifiers
- CAS
5447-94-9- PubChem CID
- 200000
- DTXSID
DTXSID50202875
Properties
Computed structural properties
- Topological polar surface area
- 27.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 119
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…