Basic information
- CAS
72490-82-5- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(O)COP(=O)([O-])COC[N+](C)(C)C- InChIKey
OMFHIZTYMHFNIE-UHFFFAOYSA-N- Molecular formula
- C26H56NO6P
- Average molar mass
- 509.7 g/mol
- Monoisotopic mass
- 509.3845255
Names & identifiers
- Preferred name
- 2-Hydroxy-3-(octadecyloxy)propyl {[(trimethylazaniumyl)methoxy]methyl}phosphonate
- IUPAC
- (2-hydroxy-3-octadecoxypropoxy)-[(trimethylazaniumyl)methoxymethyl]phosphinate
Names & synonyms
DTXSID809933202-Hydroxy-3-(octadecyloxy)propyl {[(trimethylazaniumyl)methoxy]methyl}phosphonate
Database identifiers
- CAS
72490-82-5- PubChem CID
- 149484
- DTXSID
DTXSID80993320
Properties
Computed structural properties
- XLogP
- 7
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 26
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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