1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane

C7H6F4 — CID 59771966

IUPAC1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane
SMILESC=C1C(=C)C(F)(F)CC1(F)F
InChIInChI=1S/C7H6F4/c1-4-5(2)7(10,11)3-6(4,8)9/h1-3H2
InChIKeyLMTGBZIVUHLSLN-UHFFFAOYSA-N
MW166.12 g/mol
LogP2.77
Rot. Bonds

About 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane

1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane (PubChem CID 59771966) has the molecular formula C7H6F4 and a molecular weight of 166.12 g/mol. Its IUPAC name is 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane.

Molecular Properties

Compound Name1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane
PubChem CID59771966
Molecular FormulaC7H6F4
Molecular Weight166.12 g/mol
Exact Mass166.04
IUPAC Name1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane
SMILESC=C1C(=C)C(F)(F)CC1(F)F
InChIInChI=1S/C7H6F4/c1-4-5(2)7(10,11)3-6(4,8)9/h1-3H2
InChIKeyLMTGBZIVUHLSLN-UHFFFAOYSA-N
XLogP2.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.12
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane?
The IUPAC name of 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane (CID 59771966) is 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane.
What is the SMILES notation for 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane?
The canonical SMILES for 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane is C=C1C(=C)C(F)(F)CC1(F)F.
What is the InChIKey of 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane?
The InChIKey is LMTGBZIVUHLSLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F4/c1-4-5(2)7(10,11)3-6(4,8)9/h1-3H2.
What are the key properties of 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane?
1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane has a molecular weight of 166.12 g/mol, XLogP of 2.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,4,4-tetrafluoro-2,3-dimethylidenecyclopentane is sourced from PubChem (CID 59771966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).