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Home Bromides 1049706-72-0
1049706-72-0,MFCD12828179
Catalog No.:AA003IZH

1049706-72-0 | 3-Bromo-4-methyl-5-nitro-2-pyridinone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$79.00   $55.00
- +
2.5g
95%
in stock  
$189.00   $133.00
- +
5g
95%
in stock  
$219.00   $153.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IZH
Chemical Name:
3-Bromo-4-methyl-5-nitro-2-pyridinone
CAS Number:
1049706-72-0
Molecular Formula:
C6H5BrN2O3
Molecular Weight:
233.0195
MDL Number:
MFCD12828179
SMILES:
[O-][N+](=O)c1c[nH]c(=O)c(c1C)Br
Properties
Properties
 
BP:
382.506°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
313  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
XLogP3:
0.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:SINOCHEMHOLDINGSCORPORATIONLTD;Syngenta(in:SinochemHoldings)-WO2008/101682,2008,A2Locationinpatent:Page/Pagecolumn90

[1]ACSMedicinalChemistryLetters,2020

[2]MedChemComm,2013,vol.4,p.709-719

[3]Patent:WO2019/126082,2019,A1.Locationinpatent:Page/Pagecolumn81

[4]Patent:WO2018/213211,2018,A1.Locationinpatent:Paragraph0244;0245;0246

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-WO2019/126082,2019,A1Locationinpatent:Page/Pagecolumn81

[2]Pryde,DavidC.;Webster,Rob;Butler,ScottL.;Murray,EdwardJ.;Whitby,Kevin;Pickford,Chris;Westby,Mike;Palmer,MichaelJ.;Bull,DavidJ.;Vuong,Hannah;Blakemore,DavidC.;Stead,Darren;Ashcroft,Christopher;Gardner,Iain;Bru,Claire;Cheung,Wai-Yee;Roberts,IeuanO.;Morton,Jennifer;Bissell,RichardA.[MedChemComm,2013,vol.4,#4,p.709-719]

[3]Nakajima,Ryota;Oono,Hiroyuki;Sugiyama,Sakae;Matsueda,Yohei;Ida,Tomohide;Kakuda,Shinji;Hirata,Jun;Baba,Atsushi;Makino,Akito;Matsuyama,Ryo;White,RyanD.;Wurz,RyanP.;Shin,Youngsook;Min,Xiaoshan;Guzman-Perez,Angel;Wang,Zhulun;Symons,Antony;Singh,SanjayK.;Mothe,SrinivasaReddy;Belyakov,Sergei;Chakrabarti,Anjan;Shuto,Satoshi[ACSMedicinalChemistryLetters,2020,vol.11,#4,p.528-534]

[4]CurrentPatentAssignee:UNIVERSITYOFMICHIGAN-WO2018/213211,2018,A1Locationinpatent:Paragraph0244;0247;0248

Literature
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SDS
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Tags:1049706-72-0 Molecular Formula|1049706-72-0 MDL|1049706-72-0 SMILES|1049706-72-0 3-Bromo-4-methyl-5-nitro-2-pyridinone