Home Nitro Compounds 85330-50-3
85330-50-3,MFCD09835484
Catalog No.:AA004L7R

85330-50-3 | 4-Nitro-1,3-dihydro-1,3-benzodiazol-2-one

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100mg
98%
in stock  
$18.00   $13.00
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250mg
98%
in stock  
$32.00   $22.00
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1g
98%
in stock  
$67.00   $47.00
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5g
98%
in stock  
$234.00   $164.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA004L7R
Chemical Name:
4-Nitro-1,3-dihydro-1,3-benzodiazol-2-one
CAS Number:
85330-50-3
Molecular Formula:
C7H5N3O3
Molecular Weight:
179.1329
MDL Number:
MFCD09835484
SMILES:
[O-][N+](=O)c1cccc2c1[nH]c(=O)[nH]2
Properties
Properties
 
Form:
Solid  
Storage:
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  

Downstream Synthesis Route

[1]Efros;El'zow[ZhurnalObshcheiKhimii,1958,vol.28,p.441,443;engl.Ausg.S.433,436]

[1]Patent:WO2011/120604,2011,A1.Locationinpatent:Page/Pagecolumn25;26;131

[2]Patent:EP2377850,2011,A1.Locationinpatent:Page/Pagecolumn11

[3]Patent:US6300325,2001,B1

[4]BioorganicandMedicinalChemistryLetters,1998,vol.8,p.2675-2680

[5]ZhurnalObshcheiKhimii,1958,vol.28,p.441,443;engl.Ausg.S.433,436

[1]Caronna[GazzettaChimicaItaliana,1941,vol.71,p.481,485][GazzettaChimicaItaliana,1950,vol.80,p.211,216]

[2]Maffei;Bettinetti[AnnalidiChimica,1959,vol.49,p.1809,1812]

[1]Mewshaw,RichardE.;Verwijs,Antoine;Shi,Xiaojie;McGaughey,GeorgiaB.;Nelson,JamesA.;Mazandarani,Hossein;Brennan,JulieA.;Marquis,KarenL.;Coupet,Joseph;Andree,TerranceH.[BioorganicandMedicinalChemistryLetters,1998,vol.8,#19,p.2675-2680]

[2]Efros;El'zow[ZhurnalObshcheiKhimii,1957,vol.27,p.127,130;engl.Ausg.S.143,147]

[1]Ooi,HongChin;Suschitzky,Hans[JournaloftheChemicalSociety.PerkintransactionsI,1982,#12,p.2871-2876]

Literature
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SDS
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Tags:85330-50-3 Molecular Formula|85330-50-3 MDL|85330-50-3 SMILES|85330-50-3 4-Nitro-1,3-dihydro-1,3-benzodiazol-2-one