1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane

C7H8F4 — CID 91371894

IUPAC1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane
SMILESC=C1CC(C)C(F)(F)C1(F)F
InChIInChI=1S/C7H8F4/c1-4-3-5(2)7(10,11)6(4,8)9/h5H,1,3H2,2H3
InChIKeyHHEWYTMVTNNCQG-UHFFFAOYSA-N
MW168.13 g/mol
LogP2.85
Rot. Bonds

About 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane

1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane (PubChem CID 91371894) has the molecular formula C7H8F4 and a molecular weight of 168.13 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane
PubChem CID91371894
Molecular FormulaC7H8F4
Molecular Weight168.13 g/mol
Exact Mass168.06
IUPAC Name1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane
SMILESC=C1CC(C)C(F)(F)C1(F)F
InChIInChI=1S/C7H8F4/c1-4-3-5(2)7(10,11)6(4,8)9/h5H,1,3H2,2H3
InChIKeyHHEWYTMVTNNCQG-UHFFFAOYSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.13
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'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-methyl-5-methylidenecyclopentane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane (CID 91371894) is 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane is C=C1CC(C)C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane?
The InChIKey is HHEWYTMVTNNCQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F4/c1-4-3-5(2)7(10,11)6(4,8)9/h5H,1,3H2,2H3.
What are the key properties of 1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane?
1,1,2,2-tetrafluoro-3-methyl-5-methylidenecyclopentane has a molecular weight of 168.13 g/mol, XLogP of 2.85, 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-methyl-5-methylidenecyclopentane is sourced from PubChem (CID 91371894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).