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Home Other Building Blocks 5-Chloro-7-methylisatin

5-Chloro-7-methylisatin

CAS No.:
14389-06-1
Catalog Number:
AG001ILB
Molecular Formula:
C9H6ClNO2
Molecular Weight:
195.6024
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$72
- +
5g
95%
In Stock USA
United States
$207
- +
10g
95%
In Stock USA
United States
$338
- +
25g
95%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG001ILB
Chemical Name:
5-Chloro-7-methylisatin
CAS Number:
14389-06-1
Molecular Formula:
C9H6ClNO2
Molecular Weight:
195.6024
MDL Number:
MFCD00047218
IUPAC Name:
5-chloro-7-methyl-1H-indole-2,3-dione
InChI:
InChI=1S/C9H6ClNO2/c1-4-2-5(10)3-6-7(4)11-9(13)8(6)12/h2-3H,1H3,(H,11,12,13)
InChI Key:
LDFQLYHDZZPAGN-UHFFFAOYSA-N
SMILES:
Clc1cc(C)c2c(c1)C(=O)C(=O)N2
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.009g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.602g/mol
Monoisotopic Mass:
195.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Literature
Title Journal
Chemical synthesis, in vitro acetohydroxyacid synthase (AHAS) inhibition, herbicidal activity, and computational studies of isatin derivatives. Journal of agricultural and food chemistry 20110928
Selective inhibition of carboxylesterases by isatins, indole-2,3-diones. Journal of medicinal chemistry 20070419
Properties