Basic information
- Standard SMILES
COP(=O)(COC/C=C(\C)CC/C=C(\C)CCC=C(C)C)OC- InChIKey
AKWSANUBSOJUNG-OUBUNXTGSA-N- Molecular formula
- C18H33O4P
- Average molar mass
- 344.4 g/mol
Names & identifiers
- Preferred name
- (E,E)-[[(3,7,11-Trimethyl-2,6,10-dodecatrienyl)oxy]methyl]phosphonic acid, dimethyl ester
- IUPAC
- (2E,6E)-1-(dimethoxyphosphorylmethoxy)-3,7,11-trimethyldodeca-2,6,10-triene
Names & synonyms
AKWSANUBSOJUNG-OUBUNXTGSA-N(E,E)-[[(3,7,11-Trimethyl-2,6,10-dodecatrienyl)oxy]methyl]phosphonic acid, dimethyl ester
Database identifiers
- PubChem CID
- 86747432
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 452
Related reactions
1 records
Compound notes
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