Benzenesulfonamide,4-[5-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-


Chemical Name: Benzenesulfonamide,4-[5-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]-
CAS Number: 170569-86-5
Product Number: AG00AP31(AGN-PC-0Q9P08)
Synonyms:
MDL No:
Molecular Formula: C16H11ClF3N3O2S
Molecular Weight: 401.7906

Identification/Properties


Computed Properties
Molecular Weight:
401.788g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
401.021g/mol
Monoisotopic Mass:
401.021g/mol
Topological Polar Surface Area:
86.4A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
583
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301
Precautionary Statements:
P301+P310
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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