2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane

C4F8O2 — CID 11053484

IUPAC2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane
SMILESFC1(F)OC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C4F8O2/c5-1(2(6,7)8)3(9,10)14-4(11,12)13-1
InChIKeyFFVORWYSQRKNAD-UHFFFAOYSA-N
MW232.03 g/mol
LogP2.40
Rot. Bonds

About 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane

2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane (PubChem CID 11053484) has the molecular formula C4F8O2 and a molecular weight of 232.03 g/mol. Its IUPAC name is 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane
PubChem CID11053484
Molecular FormulaC4F8O2
Molecular Weight232.03 g/mol
Exact Mass231.98
IUPAC Name2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane
SMILESFC1(F)OC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C4F8O2/c5-1(2(6,7)8)3(9,10)14-4(11,12)13-1
InChIKeyFFVORWYSQRKNAD-UHFFFAOYSA-N
XLogP2.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.03
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Difluoromethylene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 86530
2,2,4,4,5,5-Hexafluoro-1,3-dioxolane
CID 23234846
1-(Difluoro(trifluoromethoxy)methoxy)-1,1,2,3,3,3-hexafluoro-2-(trifluoromethoxy)propane
CID 52991866
1,3-Dioxolane, 4,4,5,5-tetrafluoro-2,2-bis(trifluoromethyl)-
CID 182427
2,2,4,4,5-Pentafluoro-5-(1,1,2,2,2-pentafluoroethoxy)-1,3-dioxolane
CID 10924481
2-(Difluoromethylene)-4,5-difluoro-4,5-bis(trifluoromethyl)-1,3-dioxole
CID 23085488
2,4,4,5,5-Pentafluoro-2-(trifluoromethyl)-1,3-dioxolane
CID 73057112
(5R)-2-(difluoromethylidene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 98110089
4,4,5-Trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 12846008
2,4,4,5-Tetrafluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 12846018
2,4,4,5-Tetrafluoro-2-methyl-5-(trifluoromethyl)-1,3-dioxolane
CID 12846019
2,4,4,5-Tetrafluoro-2,5-bis(trifluoromethyl)-1,3-dioxolane
CID 19745408

Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane?
The IUPAC name of 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane (CID 11053484) is 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane.
What is the SMILES notation for 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane?
The canonical SMILES for 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane is FC1(F)OC(F)(F)C(F)(C(F)(F)F)O1.
What is the InChIKey of 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane?
The InChIKey is FFVORWYSQRKNAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4F8O2/c5-1(2(6,7)8)3(9,10)14-4(11,12)13-1.
What are the key properties of 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane?
2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane has a molecular weight of 232.03 g/mol, XLogP of 2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,5-pentafluoro-5-(trifluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 11053484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).