1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane

C11F18 — CID 12563816

IUPAC1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane
SMILESFC1=C(C2(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C11F18/c12-2-1(4(14,15)8(22,23)5(2,16)17)3(13)6(18,19)9(24,25)11(28,29)10(26,27)7(3,20)21
InChIKeyBHTPIFCTEDBHSU-UHFFFAOYSA-N
MW474.09 g/mol
LogP6.03
Rot. Bonds1

About 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane

1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane (PubChem CID 12563816) has the molecular formula C11F18 and a molecular weight of 474.09 g/mol. Its IUPAC name is 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane.

Molecular Properties

Compound Name1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane
PubChem CID12563816
Molecular FormulaC11F18
Molecular Weight474.09 g/mol
Exact Mass473.97
IUPAC Name1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane
SMILESFC1=C(C2(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C11F18/c12-2-1(4(14,15)8(22,23)5(2,16)17)3(13)6(18,19)9(24,25)11(28,29)10(26,27)7(3,20)21
InChIKeyBHTPIFCTEDBHSU-UHFFFAOYSA-N
XLogP6.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.09
LogP ≤ 56.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane with MolForge

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Related Compounds

Perfluoro-1,2-dimethyl-4,5,6,7-tetrahydroindane
CID 15628708
1,3,3,4,4,5,5-Heptafluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)cyclopentene
CID 12563817
1,3,3,4,4,5,5,6,6-Nonafluoro-2-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)cyclohexene
CID 12563819
CID 71391659
CID 71391659
2-Trifluoromethylperfluorobicyclo[4.3.0]non-1(6)-ene
CID 550621
1,1,2,3,3,4,4,5,5,6,6,7,7-Tridecafluoro-2-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indene
CID 550622
Perfluoro[1-(1-ethyl-1-methylpropyl)]cyclohexene
CID 550630
Perfluoro[7-ethylbicyclo[4.3.0]-nona-1(6)-ene]
CID 576671
Perfluoro[3-methylbicyclo[4.3.0]-nona-1(6)-ene]
CID 623611
1,3,3,4,4,5,6,6-Octafluoro-2-[2,2,2-trifluoro-1,1-bis(trifluoromethyl)ethyl]-5-(trifluoromethyl)cyclohexene
CID 91695339
1,3,3,4,4,5,6,6-Octafluoro-2-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-5-(trifluoromethyl)cyclohexene
CID 91695374
3,3,4,4,5,5-Hexafluoro-1,2-bis(1,1,1,2,3,3,3-heptafluoropropan-2-yl)cyclopentene
CID 12563818

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane?
The IUPAC name of 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane (CID 12563816) is 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane.
What is the SMILES notation for 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane?
The canonical SMILES for 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane is FC1=C(C2(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane?
The InChIKey is BHTPIFCTEDBHSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11F18/c12-2-1(4(14,15)8(22,23)5(2,16)17)3(13)6(18,19)9(24,25)11(28,29)10(26,27)7(3,20)21.
What are the key properties of 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane?
1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane has a molecular weight of 474.09 g/mol, XLogP of 6.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(2,3,3,4,4,5,5-heptafluorocyclopenten-1-yl)cyclohexane is sourced from PubChem (CID 12563816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).