Home Sulfos 1-(2,2-difluoroethyl)pyrazole-4-sulfonyl chloride

1-(2,2-difluoroethyl)pyrazole-4-sulfonyl chloride

CAS No.:
1006487-21-3
Catalog Number:
AG019CRH
Molecular Formula:
C5H5ClF2N2O2S
Molecular Weight:
230.6202
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Product Description
Catalog Number:
AG019CRH
Chemical Name:
1-(2,2-difluoroethyl)pyrazole-4-sulfonyl chloride
CAS Number:
1006487-21-3
Molecular Formula:
C5H5ClF2N2O2S
Molecular Weight:
230.6202
MDL Number:
MFCD08696569
IUPAC Name:
1-(2,2-difluoroethyl)pyrazole-4-sulfonyl chloride
InChI:
InChI=1S/C5H5ClF2N2O2S/c6-13(11,12)4-1-9-10(2-4)3-5(7)8/h1-2,5H,3H2
InChI Key:
CRQMKTOAMCCPJH-UHFFFAOYSA-N
SMILES:
FC(Cn1ncc(c1)S(=O)(=O)Cl)F
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.973g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.614g/mol
Monoisotopic Mass:
229.973g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties