2-fluoro-2-fluorosulfonyloxypropane

C3H6F2O3S — CID 88649659

IUPAC2-fluoro-2-fluorosulfonyloxypropane
SMILESCC(C)(F)OS(=O)(=O)F
InChIInChI=1S/C3H6F2O3S/c1-3(2,4)8-9(5,6)7/h1-2H3
InChIKeyQOPXECHVGYLORA-UHFFFAOYSA-N
MW160.14 g/mol
LogP0.92
Rot. Bonds2

About 2-fluoro-2-fluorosulfonyloxypropane

2-fluoro-2-fluorosulfonyloxypropane (PubChem CID 88649659) has the molecular formula C3H6F2O3S and a molecular weight of 160.14 g/mol. Its IUPAC name is 2-fluoro-2-fluorosulfonyloxypropane.

Molecular Properties

Compound Name2-fluoro-2-fluorosulfonyloxypropane
PubChem CID88649659
Molecular FormulaC3H6F2O3S
Molecular Weight160.14 g/mol
Exact Mass160.00
IUPAC Name2-fluoro-2-fluorosulfonyloxypropane
SMILESCC(C)(F)OS(=O)(=O)F
InChIInChI=1S/C3H6F2O3S/c1-3(2,4)8-9(5,6)7/h1-2H3
InChIKeyQOPXECHVGYLORA-UHFFFAOYSA-N
XLogP0.92
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.14
LogP ≤ 50.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-fluoro-2-fluorosulfonyloxypropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,1,2,2-tetrafluoro-1,2-bis(fluorosulfonyloxy)ethane
CID 12665878
trifluoromethyl 1,1-difluoroethanesulfonate
CID 174493572
tert-butyl trifluoromethanesulfonate;copper
CID 175096484
2-[difluoro(fluorosulfonyloxy)methyl]-3,3-difluoro-3-fluorosulfonyloxyprop-1-ene
CID 10471472
(1,1,1,3,3,3-hexafluoro-2-methylpropan-2-yl) hydrogen sulfate
CID 87625622
1,1,2,2-tetrafluoro-1-fluorosulfonyloxy-2-nitrosoethane
CID 13024147
1,1,4,4-tetrafluoro-1,4-bis(fluorosulfonyloxy)-2,3-bis(trifluoromethoxy)butane
CID 142755679
CID 14687560
CID 14687560
lithium fluorosulfonyl hypofluorite
CID 22638452
sodium;hydride;trifluoromethyl methanesulfonate
CID 174543711
2-fluoropropan-2-yl hydrogen sulfite
CID 87625431
2-fluoro-2-fluorosulfonylpropanoic acid
CID 139448801

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-fluorosulfonyloxypropane?
The IUPAC name of 2-fluoro-2-fluorosulfonyloxypropane (CID 88649659) is 2-fluoro-2-fluorosulfonyloxypropane.
What is the SMILES notation for 2-fluoro-2-fluorosulfonyloxypropane?
The canonical SMILES for 2-fluoro-2-fluorosulfonyloxypropane is CC(C)(F)OS(=O)(=O)F.
What is the InChIKey of 2-fluoro-2-fluorosulfonyloxypropane?
The InChIKey is QOPXECHVGYLORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6F2O3S/c1-3(2,4)8-9(5,6)7/h1-2H3.
What are the key properties of 2-fluoro-2-fluorosulfonyloxypropane?
2-fluoro-2-fluorosulfonyloxypropane has a molecular weight of 160.14 g/mol, XLogP of 0.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-fluorosulfonyloxypropane is sourced from PubChem (CID 88649659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).