1,1,2,2-Tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride
Properties
- Molecular formula
- C4F9IO3S
- Molar mass
- 425.99 g/mol
- Exact mass
- 425.8469 Da
- Boiling point
- 127 °C
- logP
- 3.11Crippen estimate
- Polar surface area
- 43.4 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 5
Identifiers
CAS number
66137-74-4SMILES
O=S(=O)(F)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)IInChIKey
XSLYISNQTJHKMP-UHFFFAOYSA-NInChI
InChI=1S/C4F9IO3S/c5-1(6,14)2(7,8)17-3(9,10)4(11,12)18(13,15)16Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Ethanesulfonyl fluoride, 1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)-
- 2-(2-Iodotetrafluoroethoxy)tetrafluoroethanesulfonyl fluoride
- 2-(2-Iodo-1,1,2,2-tetrafluoroethoxy)-1,1,2,2-tetrafluoroethanesulfonyl fluoride
- 5-Iodo-octafluoropentyl-3-oxapentanesulfonyl fluoride
Work with 1,1,2,2-Tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2-[1-[Difluoro[(1,2,2-trifluoroethenyl)oxy]methyl]-1,2,2,2-tetrafluoroethoxy]-1,1,2,2-tetrafluoroethanesulfonyl fluoride16090-14-544 % similar
Perfluorobutanesulfonyl fluoride375-72-438 % similar
Perfluoro(2-ethoxyethane)sulfonic acid113507-82-738 % similar
Perfluorooctanesulfonyl fluoride307-35-737 % similar
1,1,2,2,3,3,4,4,5,5,6,6,6-Tridecafluoro-1-hexanesulfonyl fluoride423-50-737 % similar
Trifluoromethanesulfonyl fluoride335-05-733 % similar
2-Hydroxytetrafluoroethanesulfonic acid β-sultone697-18-733 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds