[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite

C4H3F7O2 — CID 58029212

IUPAC[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite
SMILESCC(F)(F)OC(F)(F)C(F)(F)OF
InChIInChI=1S/C4H3F7O2/c1-2(5,6)12-3(7,8)4(9,10)13-11/h1H3
InChIKeyPQJYFSWOXYOFDA-UHFFFAOYSA-N
MW216.05 g/mol
LogP2.70
Rot. Bonds4

About [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite

[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite (PubChem CID 58029212) has the molecular formula C4H3F7O2 and a molecular weight of 216.05 g/mol. Its IUPAC name is [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite.

Molecular Properties

Compound Name[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite
PubChem CID58029212
Molecular FormulaC4H3F7O2
Molecular Weight216.05 g/mol
Exact Mass216.00
IUPAC Name[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite
SMILESCC(F)(F)OC(F)(F)C(F)(F)OF
InChIInChI=1S/C4H3F7O2/c1-2(5,6)12-3(7,8)4(9,10)13-11/h1H3
InChIKeyPQJYFSWOXYOFDA-UHFFFAOYSA-N
XLogP2.70
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.05
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite?
The IUPAC name of [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite (CID 58029212) is [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite.
What is the SMILES notation for [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite?
The canonical SMILES for [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite is CC(F)(F)OC(F)(F)C(F)(F)OF.
What is the InChIKey of [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite?
The InChIKey is PQJYFSWOXYOFDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3F7O2/c1-2(5,6)12-3(7,8)4(9,10)13-11/h1H3.
What are the key properties of [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite?
[2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite has a molecular weight of 216.05 g/mol, XLogP of 2.70, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1,1-difluoroethoxy)-1,1,2,2-tetrafluoroethyl] hypofluorite is sourced from PubChem (CID 58029212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).