2-(1-fluorosulfonylethoxy)ethenyl hypofluorite

C4H6F2O4S — CID 173024216

IUPAC2-(1-fluorosulfonylethoxy)ethenyl hypofluorite
SMILESCC(OC=COF)S(=O)(=O)F
InChIInChI=1S/C4H6F2O4S/c1-4(11(6,7)8)9-2-3-10-5/h2-4H,1H3
InChIKeyWDYQCVKALBITGH-UHFFFAOYSA-N
MW188.15 g/mol
LogP1.02
Rot. Bonds4

About 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite

2-(1-fluorosulfonylethoxy)ethenyl hypofluorite (PubChem CID 173024216) has the molecular formula C4H6F2O4S and a molecular weight of 188.15 g/mol. Its IUPAC name is 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite.

Molecular Properties

Compound Name2-(1-fluorosulfonylethoxy)ethenyl hypofluorite
PubChem CID173024216
Molecular FormulaC4H6F2O4S
Molecular Weight188.15 g/mol
Exact Mass188.00
IUPAC Name2-(1-fluorosulfonylethoxy)ethenyl hypofluorite
SMILESCC(OC=COF)S(=O)(=O)F
InChIInChI=1S/C4H6F2O4S/c1-4(11(6,7)8)9-2-3-10-5/h2-4H,1H3
InChIKeyWDYQCVKALBITGH-UHFFFAOYSA-N
XLogP1.02
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.15
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite?
The IUPAC name of 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite (CID 173024216) is 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite.
What is the SMILES notation for 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite?
The canonical SMILES for 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite is CC(OC=COF)S(=O)(=O)F.
What is the InChIKey of 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite?
The InChIKey is WDYQCVKALBITGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F2O4S/c1-4(11(6,7)8)9-2-3-10-5/h2-4H,1H3.
What are the key properties of 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite?
2-(1-fluorosulfonylethoxy)ethenyl hypofluorite has a molecular weight of 188.15 g/mol, XLogP of 1.02, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluorosulfonylethoxy)ethenyl hypofluorite is sourced from PubChem (CID 173024216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).