Basic information
- Standard SMILES
C=CC(=O)OCC[N+](C)(C)C- InChIKey
AIUAMYPYEUQVEM-UHFFFAOYSA-N- Molecular formula
- C8H16NO2+
- Average molar mass
- 158.22 g/mol
- Monoisotopic mass
- 158.11755517
Names & identifiers
- Preferred name
- Acryloylcholine
- IUPAC
- trimethyl(2-prop-2-enoyloxyethyl)azanium
Names & synonyms
Acryloylcholine20284-80-47JF3G4YZ2RDTXSID90174148RefChem:109445DTXCID6096639Ethanaminium, N,N,N-trimethyl-2-((1-oxo-2-propenyl)oxy)-SCHEMBL20908acryloyloxyethyltrimethylammoniumCHEMBL3306057NS00005210N,N,N-Trimethyl-2-[(prop-2-enoyl)oxy]ethan-1-aminium
Show more names
N,N,N-Trimethyl-2-[(1-oxo-2-propen-1-yl)oxy]ethanaminiumEthanaminium, N,N,N-trimethyl-2-[(1-oxo-2-propen-1-yl)oxy]-
Database identifiers
- CAS
20284-80-4- PubChem CID
- 83146
- DTXSID
DTXSID90174148- ChEMBL
CHEMBL3306057- UNII
- 7JF3G4YZ2R
- Nikkaji
- J312.483E
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 1
- Complexity
- 147
Related reactions
2 records
Linked notes
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