1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane

C8H6F10 — CID 22593150

IUPAC1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane
SMILESCC1(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H6F10/c1-3(9)4(2,10)6(13,14)8(17,18)7(15,16)5(3,11)12/h1-2H3
InChIKeyLBBIUFZOTWLTKZ-UHFFFAOYSA-N
MW292.12 g/mol
LogP4.00
Rot. Bonds

About 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane

1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane (PubChem CID 22593150) has the molecular formula C8H6F10 and a molecular weight of 292.12 g/mol. Its IUPAC name is 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane.

Molecular Properties

Compound Name1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane
PubChem CID22593150
Molecular FormulaC8H6F10
Molecular Weight292.12 g/mol
Exact Mass292.03
IUPAC Name1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane
SMILESCC1(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C8H6F10/c1-3(9)4(2,10)6(13,14)8(17,18)7(15,16)5(3,11)12/h1-2H3
InChIKeyLBBIUFZOTWLTKZ-UHFFFAOYSA-N
XLogP4.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.12
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane?
The IUPAC name of 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane (CID 22593150) is 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane.
What is the SMILES notation for 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane?
The canonical SMILES for 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane is CC1(F)C(C)(F)C(F)(F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane?
The InChIKey is LBBIUFZOTWLTKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F10/c1-3(9)4(2,10)6(13,14)8(17,18)7(15,16)5(3,11)12/h1-2H3.
What are the key properties of 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane?
1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane has a molecular weight of 292.12 g/mol, XLogP of 4.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,3,4,4,5,6-decafluoro-5,6-dimethylcyclohexane is sourced from PubChem (CID 22593150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).