Basic information
- CAS
64058-27-1- Standard SMILES
OCC[N+]1(CCCl)CC1.[Cl-]- InChIKey
XARNEGDZAFKSAM-UHFFFAOYSA-M- Molecular formula
- C6H13Cl2NO
- Average molar mass
- 186.08 g/mol
- Monoisotopic mass
- 185.0374194
Names & identifiers
- Preferred name
- Aziridinium, 1-(2-chloroethyl)-1-(2-hydroxyethyl)-, chloride
- IUPAC
- 2-[1-(2-chloroethyl)aziridin-1-ium-1-yl]ethanol chloride
Names & synonyms
AZIRIDINIUM, 1-(2-CHLOROETHYL)-1-(2-HYDROXYETHYL)-, CHLORIDE64058-27-1RefChem:10774171-(beta-Chloroethyl)-1-(beta-hydroxyethyl)ethylenimonium chlorideDTXSID209824901-(2-CHLOROETHYL)-1-(2-HYDROXYETHYL)AZIRIDIN-1-IUM CHLORIDE
Database identifiers
- CAS
64058-27-1- PubChem CID
- 47155
- DTXSID
DTXSID20982490
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 93.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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