Basic information
- CAS
38939-85-4- Standard SMILES
CC(=O)OC(C)C(=O)OCC[N+](C)(C)C.[Cl-]- InChIKey
QENRWINHIGJULD-UHFFFAOYSA-M- Molecular formula
- C10H20ClNO4
- Average molar mass
- 253.72 g/mol
- Monoisotopic mass
- 253.1080858
Names & identifiers
- Preferred name
- Acetoxy-methyl acetylcholine chloride
- IUPAC
- 2-(2-acetyloxypropanoyloxy)ethyl-trimethylazanium chloride
Names & synonyms
Acetoxy-methyl acetylcholine chloride38939-85-4ETHANAMINIUM, 2-(2-(ACETYLOXY)-1-OXOPROPOXY)-N,N,N-TRIMETHYL-, CHLORIDERefChem:316984DTXSID309597742-{[2-(Acetyloxy)propanoyl]oxy}-N,N,N-trimethylethan-1-aminium chloride
Database identifiers
- CAS
38939-85-4- PubChem CID
- 38181
- DTXSID
DTXSID30959774
Properties
Computed structural properties
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…