Home Sulfos 4-(difluoromethyl)-1,3-dimethyl-1H-pyrazole-5-sulfonyl chloride

4-(difluoromethyl)-1,3-dimethyl-1H-pyrazole-5-sulfonyl chloride

CAS No.:
1909308-90-2
Catalog Number:
AG01AUO9
Molecular Formula:
C6H7ClF2N2O2S
Molecular Weight:
244.6468
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Product Description
Catalog Number:
AG01AUO9
Chemical Name:
4-(difluoromethyl)-1,3-dimethyl-1H-pyrazole-5-sulfonyl chloride
CAS Number:
1909308-90-2
Molecular Formula:
C6H7ClF2N2O2S
Molecular Weight:
244.6468
MDL Number:
MFCD29054860
IUPAC Name:
4-(difluoromethyl)-2,5-dimethylpyrazole-3-sulfonyl chloride
InChI:
InChI=1S/C6H7ClF2N2O2S/c1-3-4(5(8)9)6(11(2)10-3)14(7,12)13/h5H,1-2H3
InChI Key:
BFWLECPLJSFUNS-UHFFFAOYSA-N
SMILES:
FC(c1c(C)nn(c1S(=O)(=O)Cl)C)F
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.988g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.641g/mol
Monoisotopic Mass:
243.988g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties