2-sulfonylethenyl hypofluorite

C2HFO3S — CID 175809263

IUPAC2-sulfonylethenyl hypofluorite
SMILESO=S(=O)=C=COF
InChIInChI=1S/C2HFO3S/c3-6-1-2-7(4)5/h1H
InChIKeyHTLUBVLZDUTEHM-UHFFFAOYSA-N
MW124.09 g/mol
LogP-0.32
Rot. Bonds1

About 2-sulfonylethenyl hypofluorite

2-sulfonylethenyl hypofluorite (PubChem CID 175809263) has the molecular formula C2HFO3S and a molecular weight of 124.09 g/mol. Its IUPAC name is 2-sulfonylethenyl hypofluorite.

Molecular Properties

Compound Name2-sulfonylethenyl hypofluorite
PubChem CID175809263
Molecular FormulaC2HFO3S
Molecular Weight124.09 g/mol
Exact Mass123.96
IUPAC Name2-sulfonylethenyl hypofluorite
SMILESO=S(=O)=C=COF
InChIInChI=1S/C2HFO3S/c3-6-1-2-7(4)5/h1H
InChIKeyHTLUBVLZDUTEHM-UHFFFAOYSA-N
XLogP-0.32
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.09
LogP ≤ 5-0.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-sulfonylethenyl hypofluorite?
The IUPAC name of 2-sulfonylethenyl hypofluorite (CID 175809263) is 2-sulfonylethenyl hypofluorite.
What is the SMILES notation for 2-sulfonylethenyl hypofluorite?
The canonical SMILES for 2-sulfonylethenyl hypofluorite is O=S(=O)=C=COF.
What is the InChIKey of 2-sulfonylethenyl hypofluorite?
The InChIKey is HTLUBVLZDUTEHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HFO3S/c3-6-1-2-7(4)5/h1H.
What are the key properties of 2-sulfonylethenyl hypofluorite?
2-sulfonylethenyl hypofluorite has a molecular weight of 124.09 g/mol, XLogP of -0.32, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-sulfonylethenyl hypofluorite is sourced from PubChem (CID 175809263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).