[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite

C5H6F6O2 — CID 58825105

IUPAC[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite
SMILESFCCOC(OF)(C(F)F)C(F)F
InChIInChI=1S/C5H6F6O2/c6-1-2-12-5(13-11,3(7)8)4(9)10/h3-4H,1-2H2
InChIKeyCMHDXWYYQJNZOJ-UHFFFAOYSA-N
MW212.09 g/mol
LogP2.10
Rot. Bonds6

About [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite

[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite (PubChem CID 58825105) has the molecular formula C5H6F6O2 and a molecular weight of 212.09 g/mol. Its IUPAC name is [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite.

Molecular Properties

Compound Name[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite
PubChem CID58825105
Molecular FormulaC5H6F6O2
Molecular Weight212.09 g/mol
Exact Mass212.03
IUPAC Name[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite
SMILESFCCOC(OF)(C(F)F)C(F)F
InChIInChI=1S/C5H6F6O2/c6-1-2-12-5(13-11,3(7)8)4(9)10/h3-4H,1-2H2
InChIKeyCMHDXWYYQJNZOJ-UHFFFAOYSA-N
XLogP2.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.09
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite?
The IUPAC name of [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite (CID 58825105) is [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite.
What is the SMILES notation for [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite?
The canonical SMILES for [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite is FCCOC(OF)(C(F)F)C(F)F.
What is the InChIKey of [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite?
The InChIKey is CMHDXWYYQJNZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F6O2/c6-1-2-12-5(13-11,3(7)8)4(9)10/h3-4H,1-2H2.
What are the key properties of [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite?
[1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite has a molecular weight of 212.09 g/mol, XLogP of 2.10, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1,3,3-tetrafluoro-2-(2-fluoroethoxy)propan-2-yl] hypofluorite is sourced from PubChem (CID 58825105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).