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100511-00-0,MFCD13191795
Catalog No.:AA000253

100511-00-0 | 3,3-Dimethyl-5-nitroindolin-2-one

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100mg
95%
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$75.00   $53.00
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250mg
95%
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$142.00   $99.00
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1g
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$425.00   $298.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • 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
SMILES:
O=C1Nc2c(C1(C)C)cc(cc2)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
308  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route

[1]Brunneretal.[MonatsheftefurChemie,1931,vol.58,p.369,395]

[2]Locationinpatent:experimentalpartRawson,ThomasE.;Rüth,Matthias;Blackwood,Elizabeth;Burdick,Dan;Corson,Laura;Dotson,Jenna;Drummond,Jason;Fields,Carter;Georges,GuyJ.;Goller,Bernhard;Halladay,Jason;Hunsaker,Thomas;Kleinheinz,Tracy;Krell,Hans-Willi;Li,Jun;Liang,Jun;Limberg,Anja;McNutt,Angela;Moffat,John;Phillips,Gail;Ran,Yingqing;Safina,Brian;Ultsch,Mark;Walker,Leslie;Wiesmann,Christian;Zhang,Birong;Zhou,Aihe;Zhu,Bing-Yan;Rüger,Petra;Cochran,AndreaG.[JournalofMedicinalChemistry,2008,vol.51,#15,p.4465-4475]

[3]CurrentPatentAssignee:UNIVERSITYOFMANCHESTER-CN112119077,2020,ALocationinpatent:Paragraph0492;0495

100511-00-0   
3,3-dimethyl-5,7-dinitro-indolin-2-one 

[1]Brunneretal.[MonatsheftefurChemie,1931,vol.58,p.369,395]

[1]Brunneretal.[MonatsheftefurChemie,1931,vol.58,p.369,395]

[1]Saal,Wolfgangvonder;Hoelck,Jens-Peter;Kampe,Wolfgang;Mertens,Alfred;Mueller-Beckmann,Bernd[JournalofMedicinalChemistry,1989,vol.32,#7,p.1481-1491]

[1]Saal,Wolfgangvonder;Hoelck,Jens-Peter;Kampe,Wolfgang;Mertens,Alfred;Mueller-Beckmann,Bernd[JournalofMedicinalChemistry,1989,vol.32,#7,p.1481-1491]

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Tags:100511-00-0 Molecular Formula|100511-00-0 MDL|100511-00-0 SMILES|100511-00-0 3,3-Dimethyl-5-nitroindolin-2-one