2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane

C7H8F6O — CID 58473338

IUPAC2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
SMILESCC(F)(F)C1(F)OCC(C)(F)C1(F)F
InChIInChI=1S/C7H8F6O/c1-4(8)3-14-7(13,5(2,9)10)6(4,11)12/h3H2,1-2H3
InChIKeyOKVUFGHSIQAWDI-UHFFFAOYSA-N
MW222.13 g/mol
LogP2.70
Rot. Bonds1

About 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane

2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane (PubChem CID 58473338) has the molecular formula C7H8F6O and a molecular weight of 222.13 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
PubChem CID58473338
Molecular FormulaC7H8F6O
Molecular Weight222.13 g/mol
Exact Mass222.05
IUPAC Name2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
SMILESCC(F)(F)C1(F)OCC(C)(F)C1(F)F
InChIInChI=1S/C7H8F6O/c1-4(8)3-14-7(13,5(2,9)10)6(4,11)12/h3H2,1-2H3
InChIKeyOKVUFGHSIQAWDI-UHFFFAOYSA-N
XLogP2.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.13
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane?
The IUPAC name of 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane (CID 58473338) is 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane.
What is the SMILES notation for 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane?
The canonical SMILES for 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane is CC(F)(F)C1(F)OCC(C)(F)C1(F)F.
What is the InChIKey of 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane?
The InChIKey is OKVUFGHSIQAWDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F6O/c1-4(8)3-14-7(13,5(2,9)10)6(4,11)12/h3H2,1-2H3.
What are the key properties of 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane?
2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane has a molecular weight of 222.13 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane is sourced from PubChem (CID 58473338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).