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1593-60-8

1593-60-8 | Benzenesulfonamide, N-hydroxy-4-methyl-

CAS No: 1593-60-8 Catalog No: AG001QLI MDL No:MFCD11850835

Product Description

Catalog Number:
AG001QLI
Chemical Name:
Benzenesulfonamide, N-hydroxy-4-methyl-
CAS Number:
1593-60-8
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
MDL Number:
MFCD11850835
IUPAC Name:
N-hydroxy-4-methylbenzenesulfonamide
InChI:
InChI=1S/C7H9NO3S/c1-6-2-4-7(5-3-6)12(10,11)8-9/h2-5,8-9H,1H3
InChI Key:
XMJJPCJUQLGGND-UHFFFAOYSA-N
SMILES:
ONS(=O)(=O)c1ccc(cc1)C

Properties

Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
187.213g/mol
Monoisotopic Mass:
187.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Literature

Title Journal
Efficient and regioselective one-pot synthesis of 3-substituted and 3,5-disubstituted isoxazoles. Organic letters 20090903

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