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

C4H2F8O2 — CID 58362316

IUPAC1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFCOC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C4H2F8O2/c5-1-13-4(11,12)14-3(9,10)2(6,7)8/h1H2
InChIKeyBFIVEHIANNUMCF-UHFFFAOYSA-N
MW234.04 g/mol
LogP2.65
Rot. Bonds4

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

1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane (PubChem CID 58362316) has the molecular formula C4H2F8O2 and a molecular weight of 234.04 g/mol. Its IUPAC name is 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane.

Molecular Properties

Compound Name1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
PubChem CID58362316
Molecular FormulaC4H2F8O2
Molecular Weight234.04 g/mol
Exact Mass233.99
IUPAC Name1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
SMILESFCOC(F)(F)OC(F)(F)C(F)(F)F
InChIInChI=1S/C4H2F8O2/c5-1-13-4(11,12)14-3(9,10)2(6,7)8/h1H2
InChIKeyBFIVEHIANNUMCF-UHFFFAOYSA-N
XLogP2.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.04
LogP ≤ 52.65
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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Related Compounds

1-(Difluoromethoxy)-2-((difluoromethoxy)difluoromethoxy)-1,1,2,2-tetrafluoroethane
CID 9948255
Perfluorodiethoxymethane
CID 15218858
Perfluorodiethoxyethane
CID 15219185
2-[Difluoro(2,2,2-trifluoroethoxy)methoxy]-1,1,1-trifluoroethane
CID 14203789
1,1,1,2,2-Pentafluoro-2-{fluoro[bis(pentafluoroethoxy)]methoxy}ethane
CID 15218860
1-[[Difluoro(1,1,2,2,2-pentafluoroethoxy)methoxy]-difluoromethoxy]-1,1,2,2,2-pentafluoroethane
CID 18920693
[1,2,2,2-Tetrafluoro-1-(difluoromethoxy)ethyl](difluoromethyl) ether
CID 21187359
1,1,1-Trifluoro-2,2,2-tris(fluoromethoxy)ethane
CID 22495104
1,1,1,2-Tetrafluoro-2,2-bis(fluoromethoxy)ethane
CID 22495110
Methyl 1,1,2,2,2-pentafluoroethyl carbonate
CID 23432495
1-[1,1-Difluoroethoxy(difluoro)methoxy]-1,1,2,2,2-pentafluoroethane
CID 57724354
1-[Difluoro(trifluoromethoxy)methoxy]-1,1-difluoroethane
CID 57724428

Frequently Asked Questions

What is the IUPAC name of 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The IUPAC name of 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane (CID 58362316) is 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane.
What is the SMILES notation for 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The canonical SMILES for 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane is FCOC(F)(F)OC(F)(F)C(F)(F)F.
What is the InChIKey of 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
The InChIKey is BFIVEHIANNUMCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F8O2/c5-1-13-4(11,12)14-3(9,10)2(6,7)8/h1H2.
What are the key properties of 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane?
1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane has a molecular weight of 234.04 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane is sourced from PubChem (CID 58362316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).