Home Imidazoles 93-84-5
93-84-5,MFCD00220274
Catalog No.:AA003MTZ

93-84-5 | 5-Nitro-2-benzimidazolinone

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Purity
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Price(USD)
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1g
97%
in stock  
$8.00   $6.00
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5g
95%
in stock  
$16.00   $11.00
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10g
97%
in stock  
$26.00   $18.00
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25g
97%
in stock  
$62.00   $43.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003MTZ
Chemical Name:
5-Nitro-2-benzimidazolinone
CAS Number:
93-84-5
Molecular Formula:
C7H5N3O3
Molecular Weight:
179.1329
MDL Number:
MFCD00220274
SMILES:
[O-][N+](=O)c1ccc2c(c1)[nH]c(=O)[nH]2
NSC Number:
10380
Properties
Properties
 
BP:
203 °C at 760 mmHg  
Form:
Solid  
MP:
>300 °C(lit.);  
Storage:
Light sensitive;Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
250  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
XLogP3:
0.4  

Upstream Synthesis Route

[1]Patent:WO2012/59932,2012,A1,.Locationinpatent:Page/Pagecolumn161-162

[2]Patent:WO2009/42907,2009,A1,.Locationinpatent:Page/Pagecolumn78-79

[3]JournaloftheAmericanChemicalSociety,1958,vol.80,p.1662

[4]Patent:WO2012/115479,2012,A2,.Locationinpatent:Page/Pagecolumn23

[5]Patent:CN104151251,2017,B,.Locationinpatent:Paragraph0024

Downstream Synthesis Route

[1]ChemischeBerichte,1912,vol.45,p.3249

[1]JournaloftheAmericanChemicalSociety,1958,vol.80,p.1662

[1]Patent:US6255482,2001,B1

[2]RussianJournalofOrganicChemistry,2011,vol.47,p.1190-1193

[3]ZhurnalObshcheiKhimii,1957,vol.27,p.127,130;engl.Ausg.S.143,147

[4]Patent:US6617453,2003,B1

[1]Patent:US2007/37791,2007,A1.Locationinpatent:Page/Pagecolumn40-41

[2]Patent:US2016/60260,2016,A1.Locationinpatent:Paragraph0182

[3]JournalofHeterocyclicChemistry,1992,vol.29,p.1069-1076

[4]JournaloftheAmericanChemicalSociety,1958,vol.80,p.1662

Literature

Title: Molecular docking and enzymatic evaluation to identify selective inhibitors of aspartate semialdehyde dehydrogenase.

Journal: Bioorganic & medicinal chemistry 20120501

Title: 1-Decyl-6-nitro-1H-benzimidazol-2(3H)-one.

Journal: Acta crystallographica. Section E, Structure reports online 20111101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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