2,2-difluoro-3,3-bis(trifluoromethyl)oxolane

C6H4F8O — CID 12730901

IUPAC2,2-difluoro-3,3-bis(trifluoromethyl)oxolane
SMILESFC(F)(F)C1(C(F)(F)F)CCOC1(F)F
InChIInChI=1S/C6H4F8O/c7-4(8,9)3(5(10,11)12)1-2-15-6(3,13)14/h1-2H2
InChIKeyHIKMECCISNOXIZ-UHFFFAOYSA-N
MW244.08 g/mol
LogP3.11
Rot. Bonds

About 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane

2,2-difluoro-3,3-bis(trifluoromethyl)oxolane (PubChem CID 12730901) has the molecular formula C6H4F8O and a molecular weight of 244.08 g/mol. Its IUPAC name is 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane.

Molecular Properties

Compound Name2,2-difluoro-3,3-bis(trifluoromethyl)oxolane
PubChem CID12730901
Molecular FormulaC6H4F8O
Molecular Weight244.08 g/mol
Exact Mass244.01
IUPAC Name2,2-difluoro-3,3-bis(trifluoromethyl)oxolane
SMILESFC(F)(F)C1(C(F)(F)F)CCOC1(F)F
InChIInChI=1S/C6H4F8O/c7-4(8,9)3(5(10,11)12)1-2-15-6(3,13)14/h1-2H2
InChIKeyHIKMECCISNOXIZ-UHFFFAOYSA-N
XLogP3.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.08
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane?
The IUPAC name of 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane (CID 12730901) is 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane.
What is the SMILES notation for 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane?
The canonical SMILES for 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane is FC(F)(F)C1(C(F)(F)F)CCOC1(F)F.
What is the InChIKey of 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane?
The InChIKey is HIKMECCISNOXIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F8O/c7-4(8,9)3(5(10,11)12)1-2-15-6(3,13)14/h1-2H2.
What are the key properties of 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane?
2,2-difluoro-3,3-bis(trifluoromethyl)oxolane has a molecular weight of 244.08 g/mol, XLogP of 3.11, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-3,3-bis(trifluoromethyl)oxolane is sourced from PubChem (CID 12730901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).