Hexyl 2-dihexoxyphosphorylhexanoate
Basic information
- CAS
6316-12-7- Standard SMILES
CCCCCCOC(=O)C(CCCC)P(=O)(OCCCCCC)OCCCCCC- InChIKey
BMEMCUBESWSWAB-UHFFFAOYSA-N- Molecular formula
- C24H49O5P
- Average molar mass
- 448.6 g/mol
- Monoisotopic mass
- 448.33176166
Names & identifiers
- Preferred name
- Hexyl 2-dihexoxyphosphorylhexanoate
- IUPAC
- hexyl 2-dihexoxyphosphorylhexanoate
Names & synonyms
NSC224306316-12-7NSC-22430
Database identifiers
- CAS
6316-12-7- PubChem CID
- 229060
Properties
Computed structural properties
- XLogP
- 8.2
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 23
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 423
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Compound notes
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