Basic information
- CAS
120287-14-1- Standard SMILES
CC(C)CCCC(C)CCCC(C)CCCC(C)CCOCC(COP(=O)(O)OCCCO)OCCC(C)CCCC(C)CCCC(C)CCCC(C)C- InChIKey
ZKPLWHHAZYAADO-UHFFFAOYSA-N- Molecular formula
- C46H95O7P
- Average molar mass
- 791.2 g/mol
- Monoisotopic mass
- 790.68154236
Overview
RN and structure given in first source
Names & identifiers
- Preferred name
- 2,3-Diphytanyl-sn-glycerol-1-phospho-1'-1',3'-propanediol
- IUPAC
- 2,3-bis(3,7,11,15-tetramethylhexadecoxy)propyl 3-hydroxypropyl hydrogen phosphate
- English name
- 2,3-diphytanyl-sn-glycerol-1-phospho-1'-1',3'-propanediol
- Molecular formula
- C46H95O7P
- Molecular weight
- 791.22
Names & synonyms
Dpg-propanediol120287-14-12,3-Diphytanyl-sn-glycerol-1-phospho-1'-1',3'-propanediolRefChem:81895DTXSID809233042,3-bis[(3,7,11,15-tetramethylhexadecyl)oxy]propyl 3-hydroxypropyl hydrogen phosphatePhosphoric acid, mono(2,3-bis((3,7,11,15-tetramethylhexadecyl)oxy)propyl) mono(3-hydroxypropyl) ester, stereoisomerPhosphoric acid, mono[2,3-bis[(3,7,11,15-tetramethylhexadecyl)oxy]propyl] mono(3-hydroxypropyl) ester, stereoisomer
Database identifiers
- CAS
120287-14-1- PubChem CID
- 129103
- DTXSID
DTXSID80923304
Properties
Computed structural properties
- XLogP
- 16.3
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 40
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 855
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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