2-((Fluoro(methyl)phosphoryl)oxy)-N,N,N-trimethylpropan-1-aminium
Basic information
- CAS
79351-08-9- Standard SMILES
CC(C[N+](C)(C)C)OP(C)(=O)F- InChIKey
KNUWEQNYQILYOW-UHFFFAOYSA-N- Molecular formula
- C7H18FNO2P+
- Average molar mass
- 198.2 g/mol
- Monoisotopic mass
- 198.10591898
Names & identifiers
- Preferred name
- 2-((Fluoro(methyl)phosphoryl)oxy)-N,N,N-trimethylpropan-1-aminium
- IUPAC
- 2-[fluoro(methyl)phosphoryl]oxypropyl-trimethylazanium
Names & synonyms
79351-08-9DTXSID3010004202-((Fluoro(methyl)phosphoryl)oxy)-N,N,N-trimethylpropan-1-aminium2-{[fluoro(methyl)phosphoryl]oxy}-N,N,N-trimethylpropan-1-aminiumRefChem:1060581DTXCID701427383NIOSH/BR5778100(2-Hydroxypropyl)trimethylammonium methylphosphonofluoridateMethyl fluorophosphoryl beta-methylcholineBR57781000Ammonium, (2-hydroxypropyl)trimethyl-, inner salt, methylphosphonofluoridate, (ester)(2-Hydroxypropyl)trimethylammonium ester with methylphosphonofluoridate
Show more names
AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-, ESTER with METHYLPHOSPHONOFLUORIDATE
Database identifiers
- CAS
79351-08-9- PubChem CID
- 19749
- DTXSID
DTXSID301000420- Nikkaji
- J2.136.478I
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 1
- Complexity
- 190
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Compound notes
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