1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane

C8H10F8O2 — CID 12929800

IUPAC1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane
SMILESCC(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F
InChIInChI=1S/C8H10F8O2/c1-4(17-2-7(13,14)5(9)10)18-3-8(15,16)6(11)12/h4-6H,2-3H2,1H3
InChIKeyDJEDBFIVAIUCLI-UHFFFAOYSA-N
MW290.15 g/mol
LogP3.17
Rot. Bonds8

About 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane

1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane (PubChem CID 12929800) has the molecular formula C8H10F8O2 and a molecular weight of 290.15 g/mol. Its IUPAC name is 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane.

Molecular Properties

Compound Name1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane
PubChem CID12929800
Molecular FormulaC8H10F8O2
Molecular Weight290.15 g/mol
Exact Mass290.06
IUPAC Name1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane
SMILESCC(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F
InChIInChI=1S/C8H10F8O2/c1-4(17-2-7(13,14)5(9)10)18-3-8(15,16)6(11)12/h4-6H,2-3H2,1H3
InChIKeyDJEDBFIVAIUCLI-UHFFFAOYSA-N
XLogP3.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.15
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', '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-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane?
The IUPAC name of 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane (CID 12929800) is 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane.
What is the SMILES notation for 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane?
The canonical SMILES for 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane is CC(OCC(F)(F)C(F)F)OCC(F)(F)C(F)F.
What is the InChIKey of 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane?
The InChIKey is DJEDBFIVAIUCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F8O2/c1-4(17-2-7(13,14)5(9)10)18-3-8(15,16)6(11)12/h4-6H,2-3H2,1H3.
What are the key properties of 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane?
1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane has a molecular weight of 290.15 g/mol, XLogP of 3.17, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetrafluoro-3-[1-(2,2,3,3-tetrafluoropropoxy)ethoxy]propane is sourced from PubChem (CID 12929800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).