3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan

C6F10O — CID 139601556

IUPAC3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan
SMILESFC1=C(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)O1
InChIInChI=1S/C6F10O/c7-1-2(8)17-4(3(1,9)10,5(11,12)13)6(14,15)16
InChIKeyQPPKFGUSLXWSDY-UHFFFAOYSA-N
MW278.05 g/mol
LogP3.62
Rot. Bonds

About 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan

3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan (PubChem CID 139601556) has the molecular formula C6F10O and a molecular weight of 278.05 g/mol. Its IUPAC name is 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan.

Molecular Properties

Compound Name3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan
PubChem CID139601556
Molecular FormulaC6F10O
Molecular Weight278.05 g/mol
Exact Mass277.98
IUPAC Name3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan
SMILESFC1=C(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)O1
InChIInChI=1S/C6F10O/c7-1-2(8)17-4(3(1,9)10,5(11,12)13)6(14,15)16
InChIKeyQPPKFGUSLXWSDY-UHFFFAOYSA-N
XLogP3.62
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.05
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan?
The IUPAC name of 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan (CID 139601556) is 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan.
What is the SMILES notation for 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan?
The canonical SMILES for 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan is FC1=C(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)O1.
What is the InChIKey of 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan?
The InChIKey is QPPKFGUSLXWSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6F10O/c7-1-2(8)17-4(3(1,9)10,5(11,12)13)6(14,15)16.
What are the key properties of 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan?
3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan has a molecular weight of 278.05 g/mol, XLogP of 3.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,5-tetrafluoro-2,2-bis(trifluoromethyl)furan is sourced from PubChem (CID 139601556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).