Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCCOCC(COP(=O)([O-])OCCCCCCCCCC[N+](C)(C)C)OCc1ccccc1- InChIKey
GVXLUMXERWAHPU-UHFFFAOYSA-N- Molecular formula
- C41H78NO6P
- Average molar mass
- 712 g/mol
- Monoisotopic mass
- 711.55667621
Names & identifiers
- Preferred name
- 2-(Benzyloxy)-3-(octadecyloxy)propyl 10-trimethylammoniodecyl phosphate
- IUPAC
- (3-octadecoxy-2-phenylmethoxypropyl) 10-(trimethylazaniumyl)decyl phosphate
Names & synonyms
SCHEMBL10599060GVXLUMXERWAHPU-UHFFFAOYSA-N2-(Benzyloxy)-3-(octadecyloxy)propyl 10-trimethylammoniodecyl phosphate
Database identifiers
- PubChem CID
- 14280945
Properties
Computed structural properties
- XLogP
- 12.6
- Topological polar surface area
- 77.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 37
- Heavy atoms
- 49
- Formal charge
- 0
- Complexity
- 734
Related reactions
2 records
Compound notes
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