1,1,2,2-tetrafluoro-3-propylidenecyclopropane

C6H6F4 — CID 18960305

IUPAC1,1,2,2-tetrafluoro-3-propylidenecyclopropane
SMILESCCC=C1C(F)(F)C1(F)F
InChIInChI=1S/C6H6F4/c1-2-3-4-5(7,8)6(4,9)10/h3H,2H2,1H3
InChIKeyHPKGBZWDGCEFCH-UHFFFAOYSA-N
MW154.11 g/mol
LogP2.61
Rot. Bonds1

About 1,1,2,2-tetrafluoro-3-propylidenecyclopropane

1,1,2,2-tetrafluoro-3-propylidenecyclopropane (PubChem CID 18960305) has the molecular formula C6H6F4 and a molecular weight of 154.11 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-propylidenecyclopropane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-propylidenecyclopropane
PubChem CID18960305
Molecular FormulaC6H6F4
Molecular Weight154.11 g/mol
Exact Mass154.04
IUPAC Name1,1,2,2-tetrafluoro-3-propylidenecyclopropane
SMILESCCC=C1C(F)(F)C1(F)F
InChIInChI=1S/C6H6F4/c1-2-3-4-5(7,8)6(4,9)10/h3H,2H2,1H3
InChIKeyHPKGBZWDGCEFCH-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.11
LogP ≤ 52.61
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-propylidenecyclopropane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-propylidenecyclopropane (CID 18960305) is 1,1,2,2-tetrafluoro-3-propylidenecyclopropane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-propylidenecyclopropane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-propylidenecyclopropane is CCC=C1C(F)(F)C1(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-propylidenecyclopropane?
The InChIKey is HPKGBZWDGCEFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F4/c1-2-3-4-5(7,8)6(4,9)10/h3H,2H2,1H3.
What are the key properties of 1,1,2,2-tetrafluoro-3-propylidenecyclopropane?
1,1,2,2-tetrafluoro-3-propylidenecyclopropane has a molecular weight of 154.11 g/mol, XLogP of 2.61, 1 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-propylidenecyclopropane is sourced from PubChem (CID 18960305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).