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Phosdiphen

HCID 92304
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
36519-00-3
Standard SMILES
CCOP(=O)(Oc1ccc(Cl)cc1Cl)Oc1ccc(Cl)cc1Cl
InChIKey
HEMINMLPKZELPP-UHFFFAOYSA-N
Molecular formula
C14H11Cl4O4P
Average molar mass
416 g/mol
Monoisotopic mass
413.914907

Overview

Phosdiphen is a dichlorobenzene.

Names & identifiers

Preferred name
Phosdiphen
IUPAC
bis(2,4-dichlorophenyl) ethyl phosphate
English name
Phosdiphen
Molecular formula
C14H11Cl4O4P
Molecular weight
416.02

Names & synonyms

PhosdiphenPhosdifen36519-00-3Fosdifen [Czech]FosdifenMTO-460bis(2,4-dichlorophenyl) ethyl phosphatePhosphoric acid, bis(2,4-dichlorophenyl) ethyl esterUNII-63S618N7AK63S618N7AKDTXSID0058069RefChem:173487
Show more names
Bis-(2,4-dichlorophenyl)-ethyl phosphatePhosphoric acid bis(2,4-dichlorophenyl) ethylPhosphoric acid bis(2,4-dichlorophenyl)ethyl esterPhosphoric acid bis(2,4-dichlorophenyl)=ethyl ester
Bis(2,4-dichlorophenyl)ethyl phosphate (8CI)Bis(2,4-dichlorophenyl)ethyl phosphate (8CI)(9CI)DTXCID6031837EDPSCHEMBL28995CHEBI:82068Bis(2,4-dichlorophenyl)ethyl phosphateNS00121875

Database identifiers

CAS
36519-00-3
PubChem CID
92304
DTXSID
DTXSID0058069
ChEBI
CHEBI:82068
UNII
63S618N7AK
Nikkaji
J1.036G

Properties

Computed structural properties

XLogP
6
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
23
Formal charge
0
Complexity
396

Physicochemical properties

vapor pressure
6.6 x · 6.6 x 10-2 Pa (20 °C)
Water Solubility
0.7 mg · 0.7 mg l-1 (20 °C)
Henry's Law Constant
2.6 · 2.6×10-2 mol/(m3Pa) at 25℃, MacBean (2012)
FDA UNII
63 S618N7AK · 63S618N7AK

Chemistry & industry

Applications

UsesPhosdiphen is used specifically for the control of rice blast diseases (Pyricularia oryzae).

Suppliers1 total

上海杰股生物科技有限公司021-51698675 · [email protected]

Additional notes

DefinitionChEBI: Phosdiphen is a dichlorobenzene.

Related reactions

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Compound notes

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