3,3-difluorooxolane

C4H6F2O — CID 58056785

IUPAC3,3-difluorooxolane
SMILESFC1(F)CCOC1
InChIInChI=1S/C4H6F2O/c5-4(6)1-2-7-3-4/h1-3H2
InChIKeySNQZWUCFHZYROI-UHFFFAOYSA-N
MW108.09 g/mol
LogP1.04
Rot. Bonds

About 3,3-difluorooxolane

3,3-difluorooxolane (PubChem CID 58056785) has the molecular formula C4H6F2O and a molecular weight of 108.09 g/mol. Its IUPAC name is 3,3-difluorooxolane.

Molecular Properties

Compound Name3,3-difluorooxolane
PubChem CID58056785
Molecular FormulaC4H6F2O
Molecular Weight108.09 g/mol
Exact Mass108.04
IUPAC Name3,3-difluorooxolane
SMILESFC1(F)CCOC1
InChIInChI=1S/C4H6F2O/c5-4(6)1-2-7-3-4/h1-3H2
InChIKeySNQZWUCFHZYROI-UHFFFAOYSA-N
XLogP1.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.09
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluorooxolane?
The IUPAC name of 3,3-difluorooxolane (CID 58056785) is 3,3-difluorooxolane.
What is the SMILES notation for 3,3-difluorooxolane?
The canonical SMILES for 3,3-difluorooxolane is FC1(F)CCOC1.
What is the InChIKey of 3,3-difluorooxolane?
The InChIKey is SNQZWUCFHZYROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F2O/c5-4(6)1-2-7-3-4/h1-3H2.
What are the key properties of 3,3-difluorooxolane?
3,3-difluorooxolane has a molecular weight of 108.09 g/mol, XLogP of 1.04, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluorooxolane is sourced from PubChem (CID 58056785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).