1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane

C5F12O2 — CID 15218858

IUPAC1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C5F12O2/c6-1(7,8)3(12,13)18-5(16,17)19-4(14,15)2(9,10)11
InChIKeyNUZDQWIMOXZDHW-UHFFFAOYSA-N
MW320.03 g/mol
LogP3.88
Rot. Bonds4

About 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane

1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane (PubChem CID 15218858) has the molecular formula C5F12O2 and a molecular weight of 320.03 g/mol. Its IUPAC name is 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane.

Molecular Properties

Compound Name1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
PubChem CID15218858
Molecular FormulaC5F12O2
Molecular Weight320.03 g/mol
Exact Mass319.97
IUPAC Name1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFC(F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C5F12O2/c6-1(7,8)3(12,13)18-5(16,17)19-4(14,15)2(9,10)11
InChIKeyNUZDQWIMOXZDHW-UHFFFAOYSA-N
XLogP3.88
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.03
LogP ≤ 53.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The IUPAC name of 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane (CID 15218858) is 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane.
What is the SMILES notation for 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The canonical SMILES for 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane is FC(F)(OC(F)(F)C(F)(F)F)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The InChIKey is NUZDQWIMOXZDHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5F12O2/c6-1(7,8)3(12,13)18-5(16,17)19-4(14,15)2(9,10)11.
What are the key properties of 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane has a molecular weight of 320.03 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-1,1,2,2,2-pentafluoroethane is sourced from PubChem (CID 15218858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).