5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane

C7H5F9O — CID 58545268

IUPAC5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane
SMILESCC(F)(F)C1(F)CC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C7H5F9O/c1-3(8,9)5(12)2-4(10,11)6(13,17-5)7(14,15)16/h2H2,1H3
InChIKeyGSMBBCYRIWFXJN-UHFFFAOYSA-N
MW276.10 g/mol
LogP3.59
Rot. Bonds1

About 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane

5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane (PubChem CID 58545268) has the molecular formula C7H5F9O and a molecular weight of 276.10 g/mol. Its IUPAC name is 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane.

Molecular Properties

Compound Name5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane
PubChem CID58545268
Molecular FormulaC7H5F9O
Molecular Weight276.10 g/mol
Exact Mass276.02
IUPAC Name5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane
SMILESCC(F)(F)C1(F)CC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C7H5F9O/c1-3(8,9)5(12)2-4(10,11)6(13,17-5)7(14,15)16/h2H2,1H3
InChIKeyGSMBBCYRIWFXJN-UHFFFAOYSA-N
XLogP3.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.10
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane?
The IUPAC name of 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane (CID 58545268) is 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane.
What is the SMILES notation for 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane?
The canonical SMILES for 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane is CC(F)(F)C1(F)CC(F)(F)C(F)(C(F)(F)F)O1.
What is the InChIKey of 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane?
The InChIKey is GSMBBCYRIWFXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F9O/c1-3(8,9)5(12)2-4(10,11)6(13,17-5)7(14,15)16/h2H2,1H3.
What are the key properties of 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane?
5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane has a molecular weight of 276.10 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,1-difluoroethyl)-2,3,3,5-tetrafluoro-2-(trifluoromethyl)oxolane is sourced from PubChem (CID 58545268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).