2,2,4,5-tetrafluoro-1,3-dioxole

C3F4O2 — CID 11744752

IUPAC2,2,4,5-tetrafluoro-1,3-dioxole
SMILESFC1=C(F)OC(F)(F)O1
InChIInChI=1S/C3F4O2/c4-1-2(5)9-3(6,7)8-1
InChIKeyHFNSTEOEZJBXIF-UHFFFAOYSA-N
MW144.02 g/mol
LogP1.65
Rot. Bonds

About 2,2,4,5-tetrafluoro-1,3-dioxole

2,2,4,5-tetrafluoro-1,3-dioxole (PubChem CID 11744752) has the molecular formula C3F4O2 and a molecular weight of 144.02 g/mol. Its IUPAC name is 2,2,4,5-tetrafluoro-1,3-dioxole.

Molecular Properties

Compound Name2,2,4,5-tetrafluoro-1,3-dioxole
PubChem CID11744752
Molecular FormulaC3F4O2
Molecular Weight144.02 g/mol
Exact Mass143.98
IUPAC Name2,2,4,5-tetrafluoro-1,3-dioxole
SMILESFC1=C(F)OC(F)(F)O1
InChIInChI=1S/C3F4O2/c4-1-2(5)9-3(6,7)8-1
InChIKeyHFNSTEOEZJBXIF-UHFFFAOYSA-N
XLogP1.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.02
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,5-tetrafluoro-1,3-dioxole?
The IUPAC name of 2,2,4,5-tetrafluoro-1,3-dioxole (CID 11744752) is 2,2,4,5-tetrafluoro-1,3-dioxole.
What is the SMILES notation for 2,2,4,5-tetrafluoro-1,3-dioxole?
The canonical SMILES for 2,2,4,5-tetrafluoro-1,3-dioxole is FC1=C(F)OC(F)(F)O1.
What is the InChIKey of 2,2,4,5-tetrafluoro-1,3-dioxole?
The InChIKey is HFNSTEOEZJBXIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F4O2/c4-1-2(5)9-3(6,7)8-1.
What are the key properties of 2,2,4,5-tetrafluoro-1,3-dioxole?
2,2,4,5-tetrafluoro-1,3-dioxole has a molecular weight of 144.02 g/mol, XLogP of 1.65, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,5-tetrafluoro-1,3-dioxole is sourced from PubChem (CID 11744752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).