1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane

C4H4F6O2 — CID 22495110

IUPAC1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane
SMILESFCOC(F)(OCF)C(F)(F)F
InChIInChI=1S/C4H4F6O2/c5-1-11-4(10,12-2-6)3(7,8)9/h1-2H2
InChIKeyQUCLQUSCOCXVMP-UHFFFAOYSA-N
MW198.06 g/mol
LogP2.06
Rot. Bonds4

About 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane

1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane (PubChem CID 22495110) has the molecular formula C4H4F6O2 and a molecular weight of 198.06 g/mol. Its IUPAC name is 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane.

Molecular Properties

Compound Name1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane
PubChem CID22495110
Molecular FormulaC4H4F6O2
Molecular Weight198.06 g/mol
Exact Mass198.01
IUPAC Name1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane
SMILESFCOC(F)(OCF)C(F)(F)F
InChIInChI=1S/C4H4F6O2/c5-1-11-4(10,12-2-6)3(7,8)9/h1-2H2
InChIKeyQUCLQUSCOCXVMP-UHFFFAOYSA-N
XLogP2.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.06
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,3,3,3-Hexafluoro-2,2-dimethoxypropane
CID 22572626
2-[Difluoro(2,2,2-trifluoroethoxy)methoxy]-1,1,1-trifluoroethane
CID 14203789
1,1,1-Trifluoro-2,2,2-trimethoxyethane
CID 18927701
1,1,1,3,3,3-Hexafluoro-2,2-bis(fluoromethoxy)propane
CID 20609480
[1,2,2,2-Tetrafluoro-1-(difluoromethoxy)ethyl](difluoromethyl) ether
CID 21187359
1,1,1-Trifluoro-2,2,2-tris(fluoromethoxy)ethane
CID 22495104
1,1,2-Trifluoro-1,2,2-tris(fluoromethoxy)ethane
CID 22495108
1-[Difluoro(fluoromethoxy)methoxy]-2-fluoroethane
CID 57934668
1-[Difluoro(fluoromethoxy)methoxy]-1,1,2,2,2-pentafluoroethane
CID 58362316
1,1,1,2,2-Pentafluoro-2-(1,1,2-trifluoroethoxymethoxy)ethane
CID 59434569
Difluoro-(fluoromethoxy)-(trifluoromethoxymethoxy)methane
CID 59917906
1-[Difluoro(methoxy)methoxy]-1,1,2-trifluoroethane
CID 60020190

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane?
The IUPAC name of 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane (CID 22495110) is 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane.
What is the SMILES notation for 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane?
The canonical SMILES for 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane is FCOC(F)(OCF)C(F)(F)F.
What is the InChIKey of 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane?
The InChIKey is QUCLQUSCOCXVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4F6O2/c5-1-11-4(10,12-2-6)3(7,8)9/h1-2H2.
What are the key properties of 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane?
1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane has a molecular weight of 198.06 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2-tetrafluoro-2,2-bis(fluoromethoxy)ethane is sourced from PubChem (CID 22495110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).