Home Indole and Oxindoles 100511-00-0
100511-00-0,MFCD13191795
Catalog No.:AA000253
100511-00-0 | 3,3-Dimethyl-5-nitroindolin-2-one
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$215.00   $150.00
- +
5g
95%
in stock  
$715.00   $500.00
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10g
95%
in stock  
$1,191.00   $834.00
- +
  • Technical Information
  • Properties
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  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000253
Chemical Name:
3,3-Dimethyl-5-nitroindolin-2-one
CAS Number:
100511-00-0
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD13191795
IUPAC Name:
3,3-dimethyl-5-nitro-1H-indol-2-one
InChI:
InChI=1S/C10H10N2O3/c1-10(2)7-5-6(12(14)15)3-4-8(7)11-9(10)13/h3-5H,1-2H3,(H,11,13)
InChI Key:
UMHSOWVJQJFESZ-UHFFFAOYSA-N
SMILES:
O=C1Nc2c(C1(C)C)cc(cc2)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
3,3-Dimethyl-5-nitroindolin-2-one 
100511-00-0 
MFCD13191795 
ZINC34568191 
AKOS016011384 
PB30060 
AJ-89390 
AK122526 
NS-02212 
OR302466 
AX8246444 
4CH-022184 
2H-INDOL-2-ONE, 1,3-DIHYDRO-3,3-DIMETHYL-5-NITRO- 
CS-0036634 
FT-0750627 
ST24041113 
3,3-DIMETHYL-5-NITRO-1H-INDOL-2-ONE 
Q-1544 
3,3-Dimethyl-5-nitro-1,3-dihydro-2H-indol-2-one 
3,3-dimethyl-5-nitro-2,3-dihydro-1H-indol-2-one 
C10H10N2O3 
3,3-Dimethyl-5-nitroindolin-2-one, 95% - 1G 1g 
3,3-DIMETHYL-5-NITRO-1,3-DIHYDRO-INDOL-2-ONE 
5-Nitrodimethylindolinon 
SCHEMBL1841727 
SCHEMBL14401666 
DTXSID90573157 
UMHSOWVJQJFESZ-UHFFFAOYSA-N 
0217AA 
Literature
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