4-Methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium iodide
Basic information
- CAS
19075-28-6- Standard SMILES
COC(=O)CCC[N+](C)(C)C.[I-]- InChIKey
FBTIGVHVFNHHCQ-UHFFFAOYSA-M- Molecular formula
- C8H18INO2
- Average molar mass
- 287.14 g/mol
- Monoisotopic mass
- 287.03823
Names & identifiers
- Preferred name
- 4-Methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium iodide
- IUPAC
- (4-methoxy-4-oxobutyl)-trimethylazanium iodide
Names & synonyms
DTXSID809406524-Methoxy-N,N,N-trimethyl-4-oxobutan-1-aminium iodideRefChem:1071022DTXCID901369111(3-Carboxypropyl)trimethylammonium iodide methyl ester19075-28-6AMMONIUM, (3-CARBOXYPROPYL)TRIMETHYL-, IODIDE, METHYL ESTER
Database identifiers
- CAS
19075-28-6- PubChem CID
- 29406
- DTXSID
DTXSID80940652
Properties
Computed structural properties
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 127
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Compound notes
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