9-Octadecen-1-ol, hydrogen phosphate
Basic information
- CAS
64051-27-0- Standard SMILES
CCCCCCCCC=CCCCCCCCCOP(=O)(O)OCCCCCCCCC=CCCCCCCCC- InChIKey
WFFZELZOEWLYNK-UHFFFAOYSA-N- Molecular formula
- C36H71O4P
- Average molar mass
- 598.9 g/mol
- Monoisotopic mass
- 598.50899774
Overview
See also: 9-Octadecen-1-ol, 1,1'-(hydrogen phosphate) (annotation moved to).
Names & identifiers
- Preferred name
- 9-Octadecen-1-ol, hydrogen phosphate
- IUPAC
- bis(octadec-9-enyl) hydrogen phosphate
Names & synonyms
9-Octadecen-1-ol, hydrogen phosphateSCHEMBL6316146DTXSID40864507Dioctadec-9-en-1-yl hydrogen phosphateDi(octadec-9-en-1-yl) hydrogen phosphate
Database identifiers
- CAS
64051-27-0- PubChem CID
- 84448
- DTXSID
DTXSID40864507
Properties
Computed structural properties
- XLogP
- 14.8
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 34
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 556
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Related reactions
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Compound notes
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