Basic information
- CAS
407-17-0- Standard SMILES
C[N+](C)(C)CC(=O)OCCF.[Cl-]- InChIKey
UQALLGUSTKQKCZ-UHFFFAOYSA-M- Molecular formula
- C7H15ClFNO2
- Average molar mass
- 199.65 g/mol
- Monoisotopic mass
- 199.0775346
Names & identifiers
- Preferred name
- 2-(2-Fluoroethoxy)-N,N,N-trimethyl-2-oxoethan-1-aminium chloride
- IUPAC
- [2-(2-fluoroethoxy)-2-oxoethyl]-trimethylazanium chloride
Names & synonyms
DTXSID4098166263982-00-32-(2-Fluoroethoxy)-N,N,N-trimethyl-2-oxoethan-1-aminium chlorideRefChem:1060871DTXCID101408931AMMONIUM, ((2-FLUOROETHOXYCARBONYL)METHYL)TRIMETHYL-, CHLORIDE2-Fluoroethylbetaine hydrochloride2-Fluoroethylbetaine HClCarbo-fluoroethoxymethyl trimethyl ammonium chlorideBetaine, 2-fluoroethyl-, hydrochlorideAmmonium, trimethyl(carbo-fluoroethoxymethyl)-, chloride407-17-0
Database identifiers
- CAS
407-17-0、63982-00-3- PubChem CID
- 46044
- DTXSID
DTXSID40981662
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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