3,3,4,4-tetrafluorocyclobutene

C4H2F4 — CID 11948316

IUPAC3,3,4,4-tetrafluorocyclobutene
SMILESFC1(F)C=CC1(F)F
InChIInChI=1S/C4H2F4/c5-3(6)1-2-4(3,7)8/h1-2H
InChIKeyGHTJJDFBXCKNEO-UHFFFAOYSA-N
MW126.05 g/mol
LogP1.83
Rot. Bonds

About 3,3,4,4-tetrafluorocyclobutene

3,3,4,4-tetrafluorocyclobutene (PubChem CID 11948316) has the molecular formula C4H2F4 and a molecular weight of 126.05 g/mol. Its IUPAC name is 3,3,4,4-tetrafluorocyclobutene.

Molecular Properties

Compound Name3,3,4,4-tetrafluorocyclobutene
PubChem CID11948316
Molecular FormulaC4H2F4
Molecular Weight126.05 g/mol
Exact Mass126.01
IUPAC Name3,3,4,4-tetrafluorocyclobutene
SMILESFC1(F)C=CC1(F)F
InChIInChI=1S/C4H2F4/c5-3(6)1-2-4(3,7)8/h1-2H
InChIKeyGHTJJDFBXCKNEO-UHFFFAOYSA-N
XLogP1.83
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.05
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(2E)-1,1,1,4,4,4-Hexafluoro-2-butene
CID 5708528
cis-1,1,1,4,4,4-Hexafluoro-2-butene
CID 52991879
3,3,4,4,4-Pentafluorobut-1-ene
CID 78990
(E)-1,1,1,2,2,5,5,6,6,6-Decafluoro-3-hexene (HFO-153-10mczz-E)
CID 19780784
3,3,4,4,5,5,5-Heptafluoropent-1-ene
CID 67727
3,4,4,4-Tetrafluoro-3-(trifluoromethyl)but-1-ene
CID 2777831
1,1,1,4,4,4-Hexafluoro-2-butene
CID 2774975
(1Z)-1,3,4,4,4-Pentafluoro-3-(trifluoromethyl)but-1-ene
CID 23233249
(1E)-1,3,4,4,4-Pentafluoro-3-(trifluoromethyl)but-1-ene
CID 23233250
2,3,3-Trifluoro-1-cyclobutene
CID 13351820
1,1,3,3,4,4,4-Heptafluoro-1-butene
CID 21096859
1,3,4,4,4-Pentafluoro-3-(trifluoromethyl)but-1-ene
CID 74023403

Frequently Asked Questions

What is the IUPAC name of 3,3,4,4-tetrafluorocyclobutene?
The IUPAC name of 3,3,4,4-tetrafluorocyclobutene (CID 11948316) is 3,3,4,4-tetrafluorocyclobutene.
What is the SMILES notation for 3,3,4,4-tetrafluorocyclobutene?
The canonical SMILES for 3,3,4,4-tetrafluorocyclobutene is FC1(F)C=CC1(F)F.
What is the InChIKey of 3,3,4,4-tetrafluorocyclobutene?
The InChIKey is GHTJJDFBXCKNEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F4/c5-3(6)1-2-4(3,7)8/h1-2H.
What are the key properties of 3,3,4,4-tetrafluorocyclobutene?
3,3,4,4-tetrafluorocyclobutene has a molecular weight of 126.05 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,4,4-tetrafluorocyclobutene is sourced from PubChem (CID 11948316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).