1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane

C9H3F15 — CID 160699918

IUPAC1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane
SMILESFC1(F)CC(F)(F)C1(F)F.FC1C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C5HF9.C4H2F6/c6-1-2(7,8)4(11,12)5(13,14)3(1,9)10;5-2(6)1-3(7,8)4(2,9)10/h1H;1H2
InChIKeyRQMFUZWEJRNOCD-UHFFFAOYSA-N
MW396.09 g/mol
LogP5.18
Rot. Bonds

About 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane

1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane (PubChem CID 160699918) has the molecular formula C9H3F15 and a molecular weight of 396.09 g/mol. Its IUPAC name is 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane.

Molecular Properties

Compound Name1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane
PubChem CID160699918
Molecular FormulaC9H3F15
Molecular Weight396.09 g/mol
Exact Mass396.00
IUPAC Name1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane
SMILESFC1(F)CC(F)(F)C1(F)F.FC1C(F)(F)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C5HF9.C4H2F6/c6-1-2(7,8)4(11,12)5(13,14)3(1,9)10;5-2(6)1-3(7,8)4(2,9)10/h1H;1H2
InChIKeyRQMFUZWEJRNOCD-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.09
LogP ≤ 55.18
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-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane with MolForge

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Related Compounds

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CID 58854942
1,1,2,2,3,3,4,5,5,6-decafluorocyclohexane
CID 23233742
1,1,2,2,3,3,4,4,5,6-decafluoro-5-methylcyclohexane
CID 154317052
1-fluoro-2-methylprop-1-ene;1,1,2,2,3,3-hexafluorocyclobutane
CID 161002972
1,2,2,3,3,4-hexafluorocyclobutan-1-ol
CID 91449587
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-4a,8a-dihydronaphthalene
CID 21225585
2,2,3,3,4,5,5,6,6-nonafluorooxane
CID 73057419
2-(1,2,2,3,3,4,4,5-octafluorocyclopentyl)-1,4-dioxane
CID 13451011
1,1,2,2,3,3,4,5-octafluorocyclopentane
CID 2778426
(4R)-1,1,2,2,3,3,4,5-octafluorocyclopentane
CID 167169999
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-icosafluoro-4a,8a,9a,10a-tetrahydroanthracene
CID 88625549
1,2,2,3,3,4-hexafluorocyclobutane-1-carbonyl chloride
CID 162536529

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane?
The IUPAC name of 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane (CID 160699918) is 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane.
What is the SMILES notation for 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane?
The canonical SMILES for 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane is FC1(F)CC(F)(F)C1(F)F.FC1C(F)(F)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane?
The InChIKey is RQMFUZWEJRNOCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5HF9.C4H2F6/c6-1-2(7,8)4(11,12)5(13,14)3(1,9)10;5-2(6)1-3(7,8)4(2,9)10/h1H;1H2.
What are the key properties of 1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane?
1,1,2,2,3,3-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane has a molecular weight of 396.09 g/mol, XLogP of 5.18, 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-hexafluorocyclobutane;1,1,2,2,3,3,4,4,5-nonafluorocyclopentane is sourced from PubChem (CID 160699918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).