2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane

C14F26O6 — CID 20507001

IUPAC2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane
SMILESFC(F)(F)C(F)(OC(F)(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F
InChIInChI=1S/C14F26O6/c15-1(5(19,20)21,7(25,26)45-11(33,34)3(17)9(29,30)43-3)41-13(37,38)14(39,40)42-2(16,6(22,23)24)8(27,28)46-12(35,36)4(18)10(31,32)44-4
InChIKeyWTEGMAYZOFBVFN-UHFFFAOYSA-N
MW758.10 g/mol
LogP7.64
Rot. Bonds13

About 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane

2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane (PubChem CID 20507001) has the molecular formula C14F26O6 and a molecular weight of 758.10 g/mol. Its IUPAC name is 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane.

Molecular Properties

Compound Name2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane
PubChem CID20507001
Molecular FormulaC14F26O6
Molecular Weight758.10 g/mol
Exact Mass757.93
IUPAC Name2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane
SMILESFC(F)(F)C(F)(OC(F)(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F
InChIInChI=1S/C14F26O6/c15-1(5(19,20)21,7(25,26)45-11(33,34)3(17)9(29,30)43-3)41-13(37,38)14(39,40)42-2(16,6(22,23)24)8(27,28)46-12(35,36)4(18)10(31,32)44-4
InChIKeyWTEGMAYZOFBVFN-UHFFFAOYSA-N
XLogP7.64
TPSA61.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500758.10
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane?
The IUPAC name of 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane (CID 20507001) is 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane.
What is the SMILES notation for 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane?
The canonical SMILES for 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane is FC(F)(F)C(F)(OC(F)(F)C(F)(F)OC(F)(C(F)(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F)C(F)(F)OC(F)(F)C1(F)OC1(F)F.
What is the InChIKey of 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane?
The InChIKey is WTEGMAYZOFBVFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14F26O6/c15-1(5(19,20)21,7(25,26)45-11(33,34)3(17)9(29,30)43-3)41-13(37,38)14(39,40)42-2(16,6(22,23)24)8(27,28)46-12(35,36)4(18)10(31,32)44-4.
What are the key properties of 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane?
2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane has a molecular weight of 758.10 g/mol, XLogP of 7.64, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[2-[1-[difluoro-(2,3,3-trifluorooxiran-2-yl)methoxy]-1,1,2,3,3,3-hexafluoropropan-2-yl]oxy-1,1,2,2-tetrafluoroethoxy]-1,1,2,3,3,3-hexafluoropropoxy]-difluoromethyl]-2,3,3-trifluorooxirane is sourced from PubChem (CID 20507001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).