1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane

C7H4F6 — CID 142056544

IUPAC1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane
SMILESC=C1C(=C)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H4F6/c1-3-4(2)6(10,11)7(12,13)5(3,8)9/h1-2H2
InChIKeyLZNMJQIVXCFBSD-UHFFFAOYSA-N
MW202.10 g/mol
LogP3.02
Rot. Bonds

About 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane

1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane (PubChem CID 142056544) has the molecular formula C7H4F6 and a molecular weight of 202.10 g/mol. Its IUPAC name is 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane.

Molecular Properties

Compound Name1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane
PubChem CID142056544
Molecular FormulaC7H4F6
Molecular Weight202.10 g/mol
Exact Mass202.02
IUPAC Name1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane
SMILESC=C1C(=C)C(F)(F)C(F)(F)C1(F)F
InChIInChI=1S/C7H4F6/c1-3-4(2)6(10,11)7(12,13)5(3,8)9/h1-2H2
InChIKeyLZNMJQIVXCFBSD-UHFFFAOYSA-N
XLogP3.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.10
LogP ≤ 53.02
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 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane?
The IUPAC name of 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane (CID 142056544) is 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane.
What is the SMILES notation for 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane?
The canonical SMILES for 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane is C=C1C(=C)C(F)(F)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane?
The InChIKey is LZNMJQIVXCFBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F6/c1-3-4(2)6(10,11)7(12,13)5(3,8)9/h1-2H2.
What are the key properties of 1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane?
1,1,2,2,3,3-hexafluoro-4,5-dimethylidenecyclopentane has a molecular weight of 202.10 g/mol, XLogP of 3.02, 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-hexafluoro-4,5-dimethylidenecyclopentane is sourced from PubChem (CID 142056544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).