3,3-difluoro-4,5-dimethyl-2H-furan

C6H8F2O — CID 67968797

IUPAC3,3-difluoro-4,5-dimethyl-2H-furan
SMILESCC1=C(C)C(F)(F)CO1
InChIInChI=1S/C6H8F2O/c1-4-5(2)9-3-6(4,7)8/h3H2,1-2H3
InChIKeyQMKQUZFLFCVMKM-UHFFFAOYSA-N
MW134.12 g/mol
LogP1.95
Rot. Bonds

About 3,3-difluoro-4,5-dimethyl-2H-furan

3,3-difluoro-4,5-dimethyl-2H-furan (PubChem CID 67968797) has the molecular formula C6H8F2O and a molecular weight of 134.12 g/mol. Its IUPAC name is 3,3-difluoro-4,5-dimethyl-2H-furan.

Molecular Properties

Compound Name3,3-difluoro-4,5-dimethyl-2H-furan
PubChem CID67968797
Molecular FormulaC6H8F2O
Molecular Weight134.12 g/mol
Exact Mass134.05
IUPAC Name3,3-difluoro-4,5-dimethyl-2H-furan
SMILESCC1=C(C)C(F)(F)CO1
InChIInChI=1S/C6H8F2O/c1-4-5(2)9-3-6(4,7)8/h3H2,1-2H3
InChIKeyQMKQUZFLFCVMKM-UHFFFAOYSA-N
XLogP1.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.12
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-4,5-dimethyl-2H-furan?
The IUPAC name of 3,3-difluoro-4,5-dimethyl-2H-furan (CID 67968797) is 3,3-difluoro-4,5-dimethyl-2H-furan.
What is the SMILES notation for 3,3-difluoro-4,5-dimethyl-2H-furan?
The canonical SMILES for 3,3-difluoro-4,5-dimethyl-2H-furan is CC1=C(C)C(F)(F)CO1.
What is the InChIKey of 3,3-difluoro-4,5-dimethyl-2H-furan?
The InChIKey is QMKQUZFLFCVMKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2O/c1-4-5(2)9-3-6(4,7)8/h3H2,1-2H3.
What are the key properties of 3,3-difluoro-4,5-dimethyl-2H-furan?
3,3-difluoro-4,5-dimethyl-2H-furan has a molecular weight of 134.12 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-4,5-dimethyl-2H-furan is sourced from PubChem (CID 67968797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).