1,1,2,2-tetrafluoro-3-methylcyclopentane

C6H8F4 — CID 10511096

IUPAC1,1,2,2-tetrafluoro-3-methylcyclopentane
SMILESCC1CCC(F)(F)C1(F)F
InChIInChI=1S/C6H8F4/c1-4-2-3-5(7,8)6(4,9)10/h4H,2-3H2,1H3
InChIKeyOAKGFPNCQMXEJA-UHFFFAOYSA-N
MW156.12 g/mol
LogP2.69
Rot. Bonds

About 1,1,2,2-tetrafluoro-3-methylcyclopentane

1,1,2,2-tetrafluoro-3-methylcyclopentane (PubChem CID 10511096) has the molecular formula C6H8F4 and a molecular weight of 156.12 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-methylcyclopentane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-methylcyclopentane
PubChem CID10511096
Molecular FormulaC6H8F4
Molecular Weight156.12 g/mol
Exact Mass156.06
IUPAC Name1,1,2,2-tetrafluoro-3-methylcyclopentane
SMILESCC1CCC(F)(F)C1(F)F
InChIInChI=1S/C6H8F4/c1-4-2-3-5(7,8)6(4,9)10/h4H,2-3H2,1H3
InChIKeyOAKGFPNCQMXEJA-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.12
LogP ≤ 52.69
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-tetrafluoro-3-methylcyclopentane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-methylcyclopentane (CID 10511096) is 1,1,2,2-tetrafluoro-3-methylcyclopentane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-methylcyclopentane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-methylcyclopentane is CC1CCC(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-methylcyclopentane?
The InChIKey is OAKGFPNCQMXEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F4/c1-4-2-3-5(7,8)6(4,9)10/h4H,2-3H2,1H3.
What are the key properties of 1,1,2,2-tetrafluoro-3-methylcyclopentane?
1,1,2,2-tetrafluoro-3-methylcyclopentane has a molecular weight of 156.12 g/mol, XLogP of 2.69, 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-tetrafluoro-3-methylcyclopentane is sourced from PubChem (CID 10511096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).