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Home Bromides 67832-11-5
67832-11-5,MFCD00041461
Catalog No.:AA0033UW

67832-11-5 | 4-Bromo-2-methylbenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$12.00   $8.00
- +
10g
98%
in stock  
$14.00   $10.00
- +
25g
98%
in stock  
$22.00   $15.00
- +
100g
98%
in stock  
$84.00   $59.00
- +
500g
98%
in stock  
$417.00   $292.00
- +
  • 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:
AA0033UW
Chemical Name:
4-Bromo-2-methylbenzonitrile
CAS Number:
67832-11-5
Molecular Formula:
C8H6BrN
Molecular Weight:
196.0439
MDL Number:
MFCD00041461
SMILES:
N#Cc1ccc(cc1C)Br
NSC Number:
229305
Properties
Properties
 
BP:
259 °C at 760 mmHg  
Form:
Solid  
MP:
65-69 °C  
Refractive Index:
1.6550 (estimate)  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
158  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
XLogP3:
2.7  

Upstream Synthesis Route

[1]EuropeanJournalofMedicinalChemistry,2018,vol.155,p.754-763

[1]RussianJournalofGeneralChemistry,2010,vol.80,#8,p.1672-1676

[2]RussianJournalofGeneralChemistry,2014,vol.84,#6,p.1085-1090

[1]RussianJournalofGeneralChemistry,2013,vol.83,#3,p.492-495

[2]Zh.Obshch.Khim.,2013,vol.83,#3,p.439-442,4

[1]ChemischeBerichte,1887,vol.20,p.1017

[1]OrganicLetters,2018,vol.20,#3,p.708-711

Downstream Synthesis Route

[1]CurrentPatentAssignee:BIOGENIDECINC.-WO2020/232330,2020,A1Locationinpatent:Page/Pagecolumn90;91

[2]CurrentPatentAssignee:BIOGENIDECINC.-WO2021/87112,2021,A1Locationinpatent:Page/Pagecolumn149-150

[3]CurrentPatentAssignee:BIOGENIDECINC.-WO2022/32019,2022,A1Locationinpatent:Page/Pagecolumn197

[4]CurrentPatentAssignee:BIOGENIDECINC.-WO2022/32019,2022,A1Locationinpatent:Page/Pagecolumn197

[5]Borsche;Herbert[JustusLiebigsAnnalenderChemie,1941,vol.546,p.277,291]

[1]EuropeanJournalofMedicinalChemistry,2018,vol.155,p.754-763

[2]ChemischeBerichte,1887,vol.20,p.1017

[3]ChemischeBerichte,1887,vol.20,p.1017

[4]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.5936-5940

67832-11-5   
4-bromo-2-methylbenzamide 

[1]Patent:WO2008/51493,2008,A2.Locationinpatent:Page/Pagecolumn240

[2]Patent:WO2010/116282,2010,A1.Locationinpatent:Page/Pagecolumn56-57

[3]ChemischeBerichte,1887,vol.20,p.1017

[4]Patent:WO2006/64251,2006,A1.Locationinpatent:Page/Pagecolumn64

[1]BioorganicandMedicinalChemistryLetters,2004,vol.14,p.4585-4589

[2]Patent:EP1449844,2004,A1.Locationinpatent:Page21

[3]Patent:EP1512687,2005,A1.Locationinpatent:Page/Pagecolumn7

[4]Patent:WO2006/18443,2006,A1.Locationinpatent:Page/Pagecolumn21

[5]Patent:US6664249,2003,B1.Locationinpatent:Pagecolumn11

[6]Patent:JP5789603,2015,B2.Locationinpatent:Paragraph0346

[7]BioorganicandMedicinalChemistry,2013,vol.21,p.1880-1897

[8]Patent:WO2014/127350,2014,A1.Locationinpatent:Page/Pagecolumn146

[9]Patent:WO2010/43377,2010,A1.Locationinpatent:Page/Pagecolumn89

[10]JournalofMedicinalChemistry,2008,vol.51,p.8124-8134

[11]ChemMedChem,2019,vol.14,p.1392-1402

[1]Yang,Cuijian;EdsallJr.,Richard;Harris,HeatherA.;Zhang,Xiaochun;Manas,EricS.;Mewshaw,RichardE.[BioorganicandMedicinalChemistry,2004,vol.12,#10,p.2553-2570]

[2]Sang,Yali;Han;Pannecouque,Christophe;DeClercq,Erik;Zhuang,Chunlin;Chen[EuropeanJournalofMedicinalChemistry,2019,vol.182]

[3]Sang,Yali;Han,Sheng;Pannecouque,Christophe;DeClercq,Erik;Zhuang,Chunlin;Chen,Fener[JournalofMedicinalChemistry,2019,vol.62,#24,p.11430-11436]

Literature
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