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Trifluorovinyl chlorosulphate

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CAS Number
923-15-9
MDL Number
MFCD01075259
Purity
=95%
Smiles
FC(=C(F)OS(=O)(=O)Cl)F

Chemical Information

Trifluoroethenyl sulfurochloridate
CAS Number923-15-9
PubChem CID2778010
IUPAC Name1-chlorosulfonyloxy-1,2,2-trifluoroethene
Molecular FormulaC2ClF3O3S
Molecular Weight196.53
XLogP1.6
Topological Polar Surface Area51.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity235
SMILES
C(=C(F)F)(OS(=O)(=O)Cl)F
InChI
InChI=1S/C2ClF3O3S/c3-10(7,8)9-2(6)1(4)5
InChIKey
WCODVGWFRZCRDF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trifluoroethenyl sulfurochloridate
CAS: 923-15-9
CID: 2778010
Formula: C2ClF3O3S
MW: 196.53
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight196.53
XLogP31.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass195.9208772
Monoisotopic Mass195.9208772
Topological Polar Surface Area51.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity235
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes