Basic information
- CAS
3820-68-6- Standard SMILES
O=P(Oc1ccc(Cl)cc1Cl)(Oc1ccc(Cl)cc1Cl)Oc1ccc(Cl)cc1Cl- InChIKey
FSDYDBAXNANUQE-UHFFFAOYSA-N- Molecular formula
- C18H9Cl6O4P
- Average molar mass
- 532.9 g/mol
- Monoisotopic mass
- 529.836962
Names & identifiers
- Preferred name
- Tris(2,4-dichlorophenyl) phosphate
- IUPAC
- tris(2,4-dichlorophenyl) phosphate
- English name
- Tris(2,4-dichlorophenyl) phosphate
- Molecular formula
- C18H9Cl6O4P
- Molecular weight
- 532.96
Names & synonyms
tris(2,4-dichlorophenyl) phosphate3820-68-6Phenol, 2,4-dichloro-, phosphate (3:1)2,4-Dichlorophenol phosphate (3:1)dichlorophenyl-phosphateSCHEMBL4372626SCHEMBL29892533DTXSID50959155Phosphoric acid tri(2,4-dichlorophenyl) esterPhosphoric acid tris(2,4-dichlorophenyl) ester
Database identifiers
- CAS
3820-68-6- PubChem CID
- 77440
- DTXSID
DTXSID50959155- Nikkaji
- J173.975A
Properties
Computed structural properties
- XLogP
- 8.7
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 510
Physicochemical properties
- EPA Substance Registry System
- 2 · Phenol, 2,4-dichloro-, phosphate (3:1) (3820-68-6)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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