fluoro 1,2,2-trifluoroethenesulfonate

C2F4O3S — CID 88542228

IUPACfluoro 1,2,2-trifluoroethenesulfonate
SMILESO=S(=O)(OF)C(F)=C(F)F
InChIInChI=1S/C2F4O3S/c3-1(4)2(5)10(7,8)9-6
InChIKeyHLCUBZSOBUNYRY-UHFFFAOYSA-N
MW180.08 g/mol
LogP1.25
Rot. Bonds2

About fluoro 1,2,2-trifluoroethenesulfonate

fluoro 1,2,2-trifluoroethenesulfonate (PubChem CID 88542228) has the molecular formula C2F4O3S and a molecular weight of 180.08 g/mol. Its IUPAC name is fluoro 1,2,2-trifluoroethenesulfonate.

Molecular Properties

Compound Namefluoro 1,2,2-trifluoroethenesulfonate
PubChem CID88542228
Molecular FormulaC2F4O3S
Molecular Weight180.08 g/mol
Exact Mass179.95
IUPAC Namefluoro 1,2,2-trifluoroethenesulfonate
SMILESO=S(=O)(OF)C(F)=C(F)F
InChIInChI=1S/C2F4O3S/c3-1(4)2(5)10(7,8)9-6
InChIKeyHLCUBZSOBUNYRY-UHFFFAOYSA-N
XLogP1.25
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.08
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of fluoro 1,2,2-trifluoroethenesulfonate?
The IUPAC name of fluoro 1,2,2-trifluoroethenesulfonate (CID 88542228) is fluoro 1,2,2-trifluoroethenesulfonate.
What is the SMILES notation for fluoro 1,2,2-trifluoroethenesulfonate?
The canonical SMILES for fluoro 1,2,2-trifluoroethenesulfonate is O=S(=O)(OF)C(F)=C(F)F.
What is the InChIKey of fluoro 1,2,2-trifluoroethenesulfonate?
The InChIKey is HLCUBZSOBUNYRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C2F4O3S/c3-1(4)2(5)10(7,8)9-6.
What are the key properties of fluoro 1,2,2-trifluoroethenesulfonate?
fluoro 1,2,2-trifluoroethenesulfonate has a molecular weight of 180.08 g/mol, XLogP of 1.25, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro 1,2,2-trifluoroethenesulfonate is sourced from PubChem (CID 88542228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).