Home Sulfos 3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone

3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone

CAS No.:
89-29-2
Catalog Number:
AG00414I
Molecular Formula:
C10H11N3O3S
Molecular Weight:
253.2776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>95.0%(T)
1 week
United States
$109
- +
Product Description
Catalog Number:
AG00414I
Chemical Name:
3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone
CAS Number:
89-29-2
Molecular Formula:
C10H11N3O3S
Molecular Weight:
253.2776
MDL Number:
MFCD00035707
IUPAC Name:
3-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide
InChI:
InChI=1S/C10H11N3O3S/c1-7-5-10(14)13(12-7)8-3-2-4-9(6-8)17(11,15)16/h2-4,6H,5H2,1H3,(H2,11,15,16)
InChI Key:
ASVVGQURNHNITH-UHFFFAOYSA-N
SMILES:
CC1=NN(C(=O)C1)c1cccc(c1)S(=O)(=O)N
EC Number:
201-895-2
NSC Number:
15355
Properties
Complexity:
452  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.052g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.276g/mol
Monoisotopic Mass:
253.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties