1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane

C7H6F8 — CID 89333717

IUPAC1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane
SMILESCC1(F)C(F)(F)C(C)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H6F8/c1-3(8)5(10,11)4(2,9)7(14,15)6(3,12)13/h1-2H3
InChIKeyGUWFBQQSXCFMAB-UHFFFAOYSA-N
MW242.11 g/mol
LogP3.36
Rot. Bonds

About 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane

1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane (PubChem CID 89333717) has the molecular formula C7H6F8 and a molecular weight of 242.11 g/mol. Its IUPAC name is 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane.

Molecular Properties

Compound Name1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane
PubChem CID89333717
Molecular FormulaC7H6F8
Molecular Weight242.11 g/mol
Exact Mass242.03
IUPAC Name1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane
SMILESCC1(F)C(F)(F)C(C)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H6F8/c1-3(8)5(10,11)4(2,9)7(14,15)6(3,12)13/h1-2H3
InChIKeyGUWFBQQSXCFMAB-UHFFFAOYSA-N
XLogP3.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.11
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane?
The IUPAC name of 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane (CID 89333717) is 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane.
What is the SMILES notation for 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane?
The canonical SMILES for 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane is CC1(F)C(F)(F)C(C)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane?
The InChIKey is GUWFBQQSXCFMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F8/c1-3(8)5(10,11)4(2,9)7(14,15)6(3,12)13/h1-2H3.
What are the key properties of 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane?
1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane has a molecular weight of 242.11 g/mol, XLogP of 3.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2,3,4,4,5-octafluoro-3,5-dimethylcyclopentane is sourced from PubChem (CID 89333717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).