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Hexakis(2,2-difluoroethoxy)phosphazene

CAT: 0572-TRC-H294028-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-H294028-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
186817-57-2
Synonyms
Hexakis(1H,1H,2H-perfluoroethoxy)phosphazene;2,2,4,4,6,6-Hexakis(2,2-difluoroethoxy)-2,2,4,4,6,6-hexahydro-1,3,5,2,4,6-triazatriphosphorine
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
FC(F)COp1(OCC(F)F)np(OCC(F)F)(OCC(F)F)np(OCC(F)F)(OCC(F)F)n1
Molecular Formula
C12H18F12N3O6P3
Molecular Weight
621.19
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Hexakis(1H,1H,2H-perfluoroethoxy)phosphazene
CAS Number186817-57-2
PubChem CID44717242
IUPAC Name2,2,4,4,6,6-hexakis(2,2-difluoroethoxy)-1,3,5-triaza-2lambda5,4lambda5,6lambda5-triphosphacyclohexa-1,3,5-triene
Molecular FormulaC12H18F12N3O6P3
Molecular Weight621.19
XLogP6
Topological Polar Surface Area92.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Heavy Atom Count36
Formal Charge0
Complexity645
SMILES
C(C(F)F)OP1(=NP(=NP(=N1)(OCC(F)F)OCC(F)F)(OCC(F)F)OCC(F)F)OCC(F)F
InChI
InChI=1S/C12H18F12N3O6P3/c13-7(14)1-28-34(29-2-8(15)16)25-35(30-3-9(17)18,31-4-10(19)20)27-36(26-34,32-5-11(21)22)33-6-12(23)24/h7-12H,1-6H2
InChIKey
ZENPVEFDWIHAJJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hexakis(1H,1H,2H-perfluoroethoxy)phosphazene
CAS: 186817-57-2
CID: 44717242
Formula: C12H18F12N3O6P3
MW: 621.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight621.19
XLogP36
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count21
Rotatable Bond Count18
Exact Mass621.0216842
Monoisotopic Mass621.0216842
Topological Polar Surface Area92.5 Ų
Heavy Atom Count36
Formal Charge0
Complexity645
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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OR1022163Hexakis (decyloxy) phosphazene
PC108056Hexakis (hexafluoroisopropoxy) phosphazene
PC0874-01Hexakis (2,2,3,3-tetrafluoropropoxy) phosphazene
PC450048Hexakis (3-fluoropropoxy) phosphazene
PC108052Hexakis (2,2,3,4,4,4-hexafluorobutoxy) phosphazene
PC450169Hexakis (1H,1H-perfluorobutoxy) phosphazene
PC450173Hexakis (1H,1H-perfluorohexyloxy) phosphazene
PC450573Hexakis (HFPO hexamer alkoxy) phosphazene
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