1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane

C8H6F8 — CID 555505

IUPAC1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane
SMILESC=CC(F)(F)C(F)(F)C1CC(F)(F)C1(F)F
InChIInChI=1S/C8H6F8/c1-2-5(9,10)7(13,14)4-3-6(11,12)8(4,15)16/h2,4H,1,3H2
InChIKeyAFUDIAPLAMRHQB-UHFFFAOYSA-N
MW254.12 g/mol
LogP3.73
Rot. Bonds3

About 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane

1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane (PubChem CID 555505) has the molecular formula C8H6F8 and a molecular weight of 254.12 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane
PubChem CID555505
Molecular FormulaC8H6F8
Molecular Weight254.12 g/mol
Exact Mass254.03
IUPAC Name1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane
SMILESC=CC(F)(F)C(F)(F)C1CC(F)(F)C1(F)F
InChIInChI=1S/C8H6F8/c1-2-5(9,10)7(13,14)4-3-6(11,12)8(4,15)16/h2,4H,1,3H2
InChIKeyAFUDIAPLAMRHQB-UHFFFAOYSA-N
XLogP3.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.12
LogP ≤ 53.73
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

1,1,2,2-tetrafluoro-3-[1,1,2,2-tetrafluoro-2-(2,2,3,3-tetrafluorocyclobutyl)ethyl]cyclobutane
CID 548581
1,1,2,2-tetrafluoro-3-(1,1,2,2,2-pentafluoroethyl)cyclobutane
CID 12025751
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorododeca-1,11-diene
CID 2737145
2-chloro-1,1,2-trifluoro-3-(1,1,2,2-tetrafluorobutyl)cyclobutane
CID 556598
3,3,3-trifluoroprop-1-ene
CID 90915807
6-chloro-3,3,4,4,5,5,6,6-octafluorohex-1-ene
CID 10923361
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-ene;hydroiodide
CID 175246817
(2S)-1-chloro-2-ethenyl-1-fluorocyclopropane
CID 134934177
2,2,3,3-tetrafluoropent-4-en-1-ol
CID 130122672
2-(2,2,3,3-tetrafluorocyclobutyl)acetaldehyde
CID 168979640
1,1,2,2-tetrafluoro-3-(2-methylpropyl)cyclobutane
CID 157031904
3-(trifluoromethyl)penta-1,4-dien-3-ol
CID 169094405

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane (CID 555505) is 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane is C=CC(F)(F)C(F)(F)C1CC(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane?
The InChIKey is AFUDIAPLAMRHQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F8/c1-2-5(9,10)7(13,14)4-3-6(11,12)8(4,15)16/h2,4H,1,3H2.
What are the key properties of 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane?
1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane has a molecular weight of 254.12 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-3-(1,1,2,2-tetrafluorobut-3-enyl)cyclobutane is sourced from PubChem (CID 555505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).