pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane

C6H8F8S — CID 140507528

IUPACpentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane
SMILESFC1CC(F)C(S(F)(F)(F)(F)F)C(F)C1
InChIInChI=1S/C6H8F8S/c7-3-1-4(8)6(5(9)2-3)15(10,11,12,13)14/h3-6H,1-2H2
InChIKeyQELNFVRRRDVPFN-UHFFFAOYSA-N
MW264.18 g/mol
LogP4.46
Rot. Bonds1

About pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane

pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane (PubChem CID 140507528) has the molecular formula C6H8F8S and a molecular weight of 264.18 g/mol. Its IUPAC name is pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane.

Molecular Properties

Compound Namepentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane
PubChem CID140507528
Molecular FormulaC6H8F8S
Molecular Weight264.18 g/mol
Exact Mass264.02
IUPAC Namepentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane
SMILESFC1CC(F)C(S(F)(F)(F)(F)F)C(F)C1
InChIInChI=1S/C6H8F8S/c7-3-1-4(8)6(5(9)2-3)15(10,11,12,13)14/h3-6H,1-2H2
InChIKeyQELNFVRRRDVPFN-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.18
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Chloro-cyclohexyl-tetrafluoro-lambda6-sulfane
CID 176437543
2,3,4,5,6-Pentafluorocyclohexane-1-thiol
CID 5246782
Cyclohexyl(trifluoro)-lambda4-sulfane
CID 117669801
Pentafluoro-(4-fluorocyclohexyl)-lambda6-sulfane
CID 140478606
2,4,5-Trifluorocyclohexane-1-thiol
CID 146493403
Pentafluoro(7-fluoroheptyl)-lambda6-sulfane
CID 174871668
Pentafluoro(6-fluorohexyl)-lambda6-sulfane
CID 174871696
Cyclohexyl thiohypofluorite
CID 176085162
3,4-Difluorocyclohexane-1-thiolate
CID 44558417
3,4-Difluorocyclohexane-1-thiol
CID 44558418
2,4-Difluorothiophenol(--2,4-Difluorobenzenethiol
CID 146886350
Timtec-BB sbb000230
CID 152753266

Frequently Asked Questions

What is the IUPAC name of pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane?
The IUPAC name of pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane (CID 140507528) is pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane.
What is the SMILES notation for pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane?
The canonical SMILES for pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane is FC1CC(F)C(S(F)(F)(F)(F)F)C(F)C1.
What is the InChIKey of pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane?
The InChIKey is QELNFVRRRDVPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F8S/c7-3-1-4(8)6(5(9)2-3)15(10,11,12,13)14/h3-6H,1-2H2.
What are the key properties of pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane?
pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane has a molecular weight of 264.18 g/mol, XLogP of 4.46, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for pentafluoro-(2,4,6-trifluorocyclohexyl)-λ6-sulfane is sourced from PubChem (CID 140507528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).