1,1,2,2,3,3-hexafluorocyclohexane

C6H6F6 — CID 10607750

IUPAC1,1,2,2,3,3-hexafluorocyclohexane
SMILESFC1(F)CCCC(F)(F)C1(F)F
InChIInChI=1S/C6H6F6/c7-4(8)2-1-3-5(9,10)6(4,11)12/h1-3H2
InChIKeyVETGFAGGLLWSMH-UHFFFAOYSA-N
MW192.10 g/mol
LogP3.08
Rot. Bonds

About 1,1,2,2,3,3-hexafluorocyclohexane

1,1,2,2,3,3-hexafluorocyclohexane (PubChem CID 10607750) has the molecular formula C6H6F6 and a molecular weight of 192.10 g/mol. Its IUPAC name is 1,1,2,2,3,3-hexafluorocyclohexane.

Molecular Properties

Compound Name1,1,2,2,3,3-hexafluorocyclohexane
PubChem CID10607750
Molecular FormulaC6H6F6
Molecular Weight192.10 g/mol
Exact Mass192.04
IUPAC Name1,1,2,2,3,3-hexafluorocyclohexane
SMILESFC1(F)CCCC(F)(F)C1(F)F
InChIInChI=1S/C6H6F6/c7-4(8)2-1-3-5(9,10)6(4,11)12/h1-3H2
InChIKeyVETGFAGGLLWSMH-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.10
LogP ≤ 53.08
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-hexafluorocyclohexane?
The IUPAC name of 1,1,2,2,3,3-hexafluorocyclohexane (CID 10607750) is 1,1,2,2,3,3-hexafluorocyclohexane.
What is the SMILES notation for 1,1,2,2,3,3-hexafluorocyclohexane?
The canonical SMILES for 1,1,2,2,3,3-hexafluorocyclohexane is FC1(F)CCCC(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,3-hexafluorocyclohexane?
The InChIKey is VETGFAGGLLWSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F6/c7-4(8)2-1-3-5(9,10)6(4,11)12/h1-3H2.
What are the key properties of 1,1,2,2,3,3-hexafluorocyclohexane?
1,1,2,2,3,3-hexafluorocyclohexane has a molecular weight of 192.10 g/mol, XLogP of 3.08, 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-hexafluorocyclohexane is sourced from PubChem (CID 10607750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).