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Substance Name: 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4-trichloro-2,2,4,4,6,6-hexahydro-4,6,6-tris(2,2,3,3-tetraflouropropoxy)-
RN: 65601-41-4
InChIKey: FIMDXPQLVCKQFL-UHFFFAOYSA-N

Molecular Formula

  • C9-H9-Cl3-F12-N3-O3-P3

Molecular Weight

  • 634.4451
 
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Names and Synonyms

  • 1,3,5,2,4,6-Triazatriphosphorine, 2,2,4-trichloro-2,2,4,4,6,6-hexahydro-4,6,6-tris(2,2,3,3-tetraflouropropoxy)-

Registry Numbers

CAS Registry Number

  • 65601-41-4

System Generated Number

  • 0065601414

Structure Descriptors

InChI

1S/C9H9Cl3F12N3O3P3/c10-31(11)25-32(12,28-1-7(19,20)4(13)14)27-33(26-31,29-2-8(21,22)5(15)16)30-3-9(23,24)6(17)18/h4-6H,1-3H2

InChIKey

FIMDXPQLVCKQFL-UHFFFAOYSA-N

Smiles

C(C(F)F)(COP1(=N[P@@](OCC(C(F)F)(F)F)(=NP(=N1)(Cl)Cl)Cl)OCC(C(F)F)(F)F)(F)F

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 6.590 (none)   EST
Water Solubility 2.26E-04 mg/L 25 EST
Vapor Pressure 2.51E-06 mm Hg 25 EST
Henry's Law Constant 5.05E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.03E-12 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.