1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene

C8H2F10 — CID 88847097

IUPAC1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene
SMILESFC1=C(F)C(F)C(F)(C(F)C(F)(F)F)C(F)=C1F
InChIInChI=1S/C8H2F10/c9-1-2(10)4(12)7(15,5(13)3(1)11)6(14)8(16,17)18/h4,6H
InChIKeyYTGFTMIBTYEXTA-UHFFFAOYSA-N
MW288.08 g/mol
LogP4.25
Rot. Bonds1

About 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene

1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene (PubChem CID 88847097) has the molecular formula C8H2F10 and a molecular weight of 288.08 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene
PubChem CID88847097
Molecular FormulaC8H2F10
Molecular Weight288.08 g/mol
Exact Mass288.00
IUPAC Name1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene
SMILESFC1=C(F)C(F)C(F)(C(F)C(F)(F)F)C(F)=C1F
InChIInChI=1S/C8H2F10/c9-1-2(10)4(12)7(15,5(13)3(1)11)6(14)8(16,17)18/h4,6H
InChIKeyYTGFTMIBTYEXTA-UHFFFAOYSA-N
XLogP4.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.08
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene?
The IUPAC name of 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene (CID 88847097) is 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene.
What is the SMILES notation for 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene?
The canonical SMILES for 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene is FC1=C(F)C(F)C(F)(C(F)C(F)(F)F)C(F)=C1F.
What is the InChIKey of 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene?
The InChIKey is YTGFTMIBTYEXTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H2F10/c9-1-2(10)4(12)7(15,5(13)3(1)11)6(14)8(16,17)18/h4,6H.
What are the key properties of 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene?
1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene has a molecular weight of 288.08 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexafluoro-5-(1,2,2,2-tetrafluoroethyl)cyclohexa-1,3-diene is sourced from PubChem (CID 88847097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).