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Home > Sulfanilamide > 859490-38-3
859490-38-3 | 4-cyano-3-methylbenzene-1-sulfonamide
CAS No: 859490-38-3 Catalog No: AG01BEL4 MDL No:MFCD18394315
Product Description
Catalog Number:
AG01BEL4
Chemical Name:
4-cyano-3-methylbenzene-1-sulfonamide
CAS Number:
859490-38-3
Molecular Formula:
C8H8N2O2S
Molecular Weight:
196.2263
MDL Number:
MFCD18394315
IUPAC Name:
4-cyano-3-methylbenzenesulfonamide
InChI:
InChI=1S/C8H8N2O2S/c1-6-4-8(13(10,11)12)3-2-7(6)5-9/h2-4H,1H3,(H2,10,11,12)
InChI Key:
BMNMZKJGCKWHCD-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1C)S(=O)(=O)N
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.031g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.224g/mol
Monoisotopic Mass:
196.031g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
92.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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