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Home Sulfos 2-Methoxy-benzenesulfonamide

2-Methoxy-benzenesulfonamide

CAS No.:
52960-57-3
Catalog Number:
AG0039SK
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$69
- +
1g
96%
In Stock USA
United States
$163
- +
5g
96%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG0039SK
Chemical Name:
2-Methoxy-benzenesulfonamide
CAS Number:
52960-57-3
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
MDL Number:
MFCD06496492
IUPAC Name:
2-methoxybenzenesulfonamide
InChI:
InChI=1S/C7H9NO3S/c1-11-6-4-2-3-5-7(6)12(8,9)10/h2-5H,1H3,(H2,8,9,10)
InChI Key:
MKQNYQGIPARLKO-UHFFFAOYSA-N
SMILES:
COc1ccccc1S(=O)(=O)N
Properties
Complexity:
232  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
187.213g/mol
Monoisotopic Mass:
187.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Literature
Title Journal
Computational study of the interactions between guanine derivatives and cyclin-dependent kinase 2 (CDK2) by CoMFA and QM/MM. Journal of chemical information and modeling 20100101
Properties