1,1,1-trifluoro-2-fluorosulfinyloxyethane

C2H2F4O2S — CID 12583890

IUPAC1,1,1-trifluoro-2-fluorosulfinyloxyethane
SMILESO=S(F)OCC(F)(F)F
InChIInChI=1S/C2H2F4O2S/c3-2(4,5)1-8-9(6)7/h1H2
InChIKeyWZWFRZRRQVKTJU-UHFFFAOYSA-N
MW166.09 g/mol
LogP1.11
Rot. Bonds2

About 1,1,1-trifluoro-2-fluorosulfinyloxyethane

1,1,1-trifluoro-2-fluorosulfinyloxyethane (PubChem CID 12583890) has the molecular formula C2H2F4O2S and a molecular weight of 166.09 g/mol. Its IUPAC name is 1,1,1-trifluoro-2-fluorosulfinyloxyethane.

Molecular Properties

Compound Name1,1,1-trifluoro-2-fluorosulfinyloxyethane
PubChem CID12583890
Molecular FormulaC2H2F4O2S
Molecular Weight166.09 g/mol
Exact Mass165.97
IUPAC Name1,1,1-trifluoro-2-fluorosulfinyloxyethane
SMILESO=S(F)OCC(F)(F)F
InChIInChI=1S/C2H2F4O2S/c3-2(4,5)1-8-9(6)7/h1H2
InChIKeyWZWFRZRRQVKTJU-UHFFFAOYSA-N
XLogP1.11
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.09
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Bis(2,2,2-trifluoroethyl) sulfite
CID 318171
1,1,1,3,3,3-Hexafluoro-2-fluorosulfinyloxypropane
CID 134934917
Chlorosulfurous acid, 2,2,3,3-tetrafluoropropyl ester
CID 11481313
2,2,2-Trifluoroethyl sulfurofluoridate
CID 12397780
2,2,2-Trifluoroethyl trifluoromethyl sulfate
CID 21270370
1,1,1,2-Tetrafluoro-2-fluorosulfonyloxyethane
CID 174345300
(Fluosulfonyloxy)hexafluoropropane
CID 129879034
1,1,1-Trifluoro-3-fluorosulfonyloxypropane
CID 178326877
2,2,2-Trifluoroethyl sulfite
CID 14381801
2,2,3,3,3-Pentafluoropropyl sulfite
CID 17910095
2,2-Difluoroethyl sulfite
CID 56980133
1,2,2,2-Tetrafluoroethyl sulfite
CID 57302582

Frequently Asked Questions

What is the IUPAC name of 1,1,1-trifluoro-2-fluorosulfinyloxyethane?
The IUPAC name of 1,1,1-trifluoro-2-fluorosulfinyloxyethane (CID 12583890) is 1,1,1-trifluoro-2-fluorosulfinyloxyethane.
What is the SMILES notation for 1,1,1-trifluoro-2-fluorosulfinyloxyethane?
The canonical SMILES for 1,1,1-trifluoro-2-fluorosulfinyloxyethane is O=S(F)OCC(F)(F)F.
What is the InChIKey of 1,1,1-trifluoro-2-fluorosulfinyloxyethane?
The InChIKey is WZWFRZRRQVKTJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2F4O2S/c3-2(4,5)1-8-9(6)7/h1H2.
What are the key properties of 1,1,1-trifluoro-2-fluorosulfinyloxyethane?
1,1,1-trifluoro-2-fluorosulfinyloxyethane has a molecular weight of 166.09 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1-trifluoro-2-fluorosulfinyloxyethane is sourced from PubChem (CID 12583890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).