Basic information
- CAS
56827-92-0- Standard SMILES
CCCCCCCCCCCCCCCCOP(=O)(Oc1ccccc1)Oc1ccccc1- InChIKey
FEUQWJRZKZQFAO-UHFFFAOYSA-N- Molecular formula
- C28H43O4P
- Average molar mass
- 474.6 g/mol
- Monoisotopic mass
- 474.28989685
Names & identifiers
- Preferred name
- Phosphoric acid, hexadecyl diphenyl ester
- IUPAC
- hexadecyl diphenyl phosphate
- English name
- Phosphoric acid, hexadecyl diphenyl ester
- Molecular formula
- C28H43O4P
- Molecular weight
- 474.61
Names & synonyms
hexadecyl diphenyl phosphate56827-92-0Phosphoric acid, hexadecyl diphenyl esterDTXSID9069132RefChem:862601DTXCID4042123SCHEMBL1547954FEUQWJRZKZQFAO-UHFFFAOYSA-NNS00113609
Database identifiers
- CAS
56827-92-0- PubChem CID
- 92540
- DTXSID
DTXSID9069132- Nikkaji
- J1.168.182D
Properties
Computed structural properties
- XLogP
- 10.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 20
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 462
Physicochemical properties
- Melting point
- 21 · 21-22 °C
- Boiling point
- 190 · 190-195 °C(Press: 10-13 Torr)
- Density
- 1.012 g/cm3 · 1.012 g/cm3(Temp: 25 °C)
- EPA Substance Registry System
- Phosphoric acid, hexadecyl diphenyl ester (56827-92-0)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Phosphoric acid, hexadecyl diphenyl ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhosphoric acid, hexadecyl diphenyl ester: ACTIVE
Applications
UsesHexadecyl Diphenyl Phosphate has been used in the preparation of synthetic analogues of Irlbacholine, which is a novel antifungal plant metabolite isolated from Irlbachia Alata.
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…