Home Nitro Compounds 196194-98-6
196194-98-6,MFCD10568173
Catalog No.:AA003G7P

196194-98-6 | 2-Acetamido-5-methoxy-4-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$381.00   $267.00
- +
5g
95%
in stock  
$1,059.00   $742.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003G7P
Chemical Name:
2-Acetamido-5-methoxy-4-nitrobenzoic acid
CAS Number:
196194-98-6
Molecular Formula:
C10H10N2O6
Molecular Weight:
254.1962
MDL Number:
MFCD10568173
SMILES:
COc1cc(C(=O)O)c(cc1[N+](=O)[O-])NC(=O)C
Properties
Properties
 
BP:
526.4°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
353  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
1  

Downstream Synthesis Route

[1]Patent:CN103382182,2016,B.Locationinpatent:Paragraph0569;0571;0576;0577

[2]Tetrahedron,2012,vol.68,p.4501-4505

[3]JournaloftheChemicalSociety,1944,p.619,622

[4]Patent:WO2004/7437,2004,A1.Locationinpatent:Page/Pagecolumn48-49

[1]Hennequin,LaurentF.;Thomas,AndrewP.;Johnstone,Craig;Stokes,ElaineS.E.;Plé,PatrickA.;Lohmann,Jean-JacquesM.;Ogilvie,DonaldJ.;Dukes,Mike;Wedge,SteveR.;Curwen,JonO.;Kendrew,Jane;Lambert-VanDerBrempt,Christine[JournalofMedicinalChemistry,1999,vol.42,#26,p.5369-5389]

[2]CurrentPatentAssignee:ZenecaLimited-US6184225,2001,B2

[3]CurrentPatentAssignee:UNIVHEBEIMEDICAL-CN103382182,2016,BLocationinpatent:Paragraph0569;0571;0578;0579

[4]CurrentPatentAssignee:SANOFI-WO2004/7437,2004,A1Locationinpatent:Page/Pagecolumn49

[5]Dewar[JournaloftheChemicalSociety,1944,p.619,622]MacMillan[JournaloftheChemicalSociety,1952,p.4019,4021]

[1]Patent:US6184225,2001,B2

Literature
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SDS
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Tags:196194-98-6 Molecular Formula|196194-98-6 MDL|196194-98-6 SMILES|196194-98-6 2-Acetamido-5-methoxy-4-nitrobenzoic acid