Home Sulfos 1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonamide

1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonamide

CAS No.:
101457-07-2
Catalog Number:
AG01AMAU
Molecular Formula:
C5H6F3N3O2S
Molecular Weight:
229.1802
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Product Description
Catalog Number:
AG01AMAU
Chemical Name:
1-methyl-3-(trifluoromethyl)-1H-pyrazole-4-sulfonamide
CAS Number:
101457-07-2
Molecular Formula:
C5H6F3N3O2S
Molecular Weight:
229.1802
MDL Number:
MFCD18426036
IUPAC Name:
1-methyl-3-(trifluoromethyl)pyrazole-4-sulfonamide
InChI:
InChI=1S/C5H6F3N3O2S/c1-11-2-3(14(9,12)13)4(10-11)5(6,7)8/h2H,1H3,(H2,9,12,13)
InChI Key:
PNFNZHBLXSLIEG-UHFFFAOYSA-N
SMILES:
Cn1nc(c(c1)S(=O)(=O)N)C(F)(F)F
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.013g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
229.177g/mol
Monoisotopic Mass:
229.013g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties