(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one

C7H2F6O2 — CID 10105319

IUPAC(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one
SMILESO=C1C=C/C(=C(/F)C(F)(F)C(F)(F)F)O1
InChIInChI=1S/C7H2F6O2/c8-5(3-1-2-4(14)15-3)6(9,10)7(11,12)13/h1-2H/b5-3-
InChIKeyZDALNPCIJRBBQU-HYXAFXHYSA-N
MW232.08 g/mol
LogP2.48
Rot. Bonds1

About (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one

(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one (PubChem CID 10105319) has the molecular formula C7H2F6O2 and a molecular weight of 232.08 g/mol. Its IUPAC name is (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one.

Molecular Properties

Compound Name(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one
PubChem CID10105319
Molecular FormulaC7H2F6O2
Molecular Weight232.08 g/mol
Exact Mass232.00
IUPAC Name(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one
SMILESO=C1C=C/C(=C(/F)C(F)(F)C(F)(F)F)O1
InChIInChI=1S/C7H2F6O2/c8-5(3-1-2-4(14)15-3)6(9,10)7(11,12)13/h1-2H/b5-3-
InChIKeyZDALNPCIJRBBQU-HYXAFXHYSA-N
XLogP2.48
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.08
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one?
The IUPAC name of (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one (CID 10105319) is (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one.
What is the SMILES notation for (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one?
The canonical SMILES for (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one is O=C1C=C/C(=C(/F)C(F)(F)C(F)(F)F)O1.
What is the InChIKey of (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one?
The InChIKey is ZDALNPCIJRBBQU-HYXAFXHYSA-N. The full InChI is InChI=1S/C7H2F6O2/c8-5(3-1-2-4(14)15-3)6(9,10)7(11,12)13/h1-2H/b5-3-.
What are the key properties of (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one?
(5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one has a molecular weight of 232.08 g/mol, XLogP of 2.48, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-5-(1,2,2,3,3,3-hexafluoropropylidene)furan-2-one is sourced from PubChem (CID 10105319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).