1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole

C5HF7O2 — CID 122422321

IUPAC1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole
SMILESFC(F)=C(F)F.FC1=C(F)C(F)OO1
InChIInChI=1S/C3HF3O2.C2F4/c4-1-2(5)7-8-3(1)6;3-1(4)2(5)6/h2H;
InChIKeyUDBLLLNATLZJKI-UHFFFAOYSA-N
MW226.05 g/mol
LogP3.34
Rot. Bonds

About 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole

1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole (PubChem CID 122422321) has the molecular formula C5HF7O2 and a molecular weight of 226.05 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole.

Molecular Properties

Compound Name1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole
PubChem CID122422321
Molecular FormulaC5HF7O2
Molecular Weight226.05 g/mol
Exact Mass225.99
IUPAC Name1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole
SMILESFC(F)=C(F)F.FC1=C(F)C(F)OO1
InChIInChI=1S/C3HF3O2.C2F4/c4-1-2(5)7-8-3(1)6;3-1(4)2(5)6/h2H;
InChIKeyUDBLLLNATLZJKI-UHFFFAOYSA-N
XLogP3.34
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.05
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole?
The IUPAC name of 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole (CID 122422321) is 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole.
What is the SMILES notation for 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole?
The canonical SMILES for 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole is FC(F)=C(F)F.FC1=C(F)C(F)OO1.
What is the InChIKey of 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole?
The InChIKey is UDBLLLNATLZJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HF3O2.C2F4/c4-1-2(5)7-8-3(1)6;3-1(4)2(5)6/h2H;.
What are the key properties of 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole?
1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole has a molecular weight of 226.05 g/mol, XLogP of 3.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoroethene;3,4,5-trifluoro-3H-dioxole is sourced from PubChem (CID 122422321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).