Basic information
- CAS
45117-80-4- Standard SMILES
C=C(C)C(=O)OCC[N+](C)(CC)CC.[Cl-]- InChIKey
NDCAQOIUIIGHEU-UHFFFAOYSA-M- Molecular formula
- C11H22ClNO2
- Average molar mass
- 235.75 g/mol
- Monoisotopic mass
- 235.1339066
Names & identifiers
- Preferred name
- Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium chloride
- IUPAC
- diethyl-methyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium chloride
- English name
- diethylmethyl[2-[(2-methyl-1-oxoallyl)oxy]ethyl]ammonium chloride
- Molecular formula
- C11H22ClNO2
- Molecular weight
- 235.75088
Names & synonyms
EINECS 256-193-945117-80-4Diethylmethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)ammonium chlorideSCHEMBL475669DTXSID10963339NS00088896beta-methacryloxyethyl diethylmethyl ammonium chlorideN,N-Diethyl-N-methyl-2-[(2-methylprop-2-enoyl)oxy]ethan-1-aminium chloridediethylmethyl[2-[(2-methyl-1-oxoallyl)oxy]ethyl]ammonium chloride
Database identifiers
- CAS
45117-80-4- PubChem CID
- 21902297
- DTXSID
DTXSID10963339- EC Number
- 256-193-9
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 207
Related reactions
1 records
Compound notes
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