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Home Bromides 457051-12-6
457051-12-6,MFCD18390221
Catalog No.:AA00DL56

457051-12-6 | 4-Bromo-2-(bromomethyl)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$112.00   $78.00
- +
1g
98%
in stock  
$261.00   $183.00
- +
5g
98%
in stock  
$809.00   $567.00
- +
10g
98%
in stock  
$1,407.00   $985.00
- +
25g
98%
in stock  
$2,804.00   $1,963.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DL56
Chemical Name:
4-Bromo-2-(bromomethyl)benzonitrile
CAS Number:
457051-12-6
Molecular Formula:
C8H5Br2N
Molecular Weight:
274.9400
MDL Number:
MFCD18390221
SMILES:
BrCc1cc(Br)ccc1C#N
Properties
Computed Properties
 
Complexity:
172  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.9  

Downstream Synthesis Route

[1]Patent:WO2007/68905,2007,A1.Locationinpatent:Page/Pagecolumn85-86

[2]JournalofMedicinalChemistry,2008,vol.51,p.6808-6828

[3]Patent:WO2016/168633,2016,A1.Locationinpatent:Page/Pagecolumn193

[4]TetrahedronLetters,2007,vol.48,p.487-489

[5]BioorganicandMedicinalChemistryLetters,2008,vol.18,p.336-343

[6]Patent:WO2015/89337,2015,A1.Locationinpatent:Paragraph0455

[7]Patent:WO2015/103756,2015,A1.Locationinpatent:Page/Pagecolumn34

[8]Patent:WO2015/105736,2015,A1.Locationinpatent:Page/Pagecolumn36

[9]Patent:WO2016/8064,2016,A1.Locationinpatent:Page/Pagecolumn52

[10]Patent:WO2016/44770,2016,A1.Locationinpatent:Page/Pagecolumn939;940

[11]Patent:US2017/37037,2017,A1.Locationinpatent:Paragraph0136

[1]CurrentPatentAssignee:UNIVERSITYOFOXFORD;OxfordUniversityInnovation(in:OxfordUniversity)-WO2005/118560,2005,A1Locationinpatent:Page/Pagecolumn83-84

N-bromosuccinamide 
  67832-11-5    457051-12-6 

[1]Patent:US2005/250753,2005,A1.Locationinpatent:Page/Pagecolumn99-100

16066-84-5    457051-12-6   
tert-butyl5-bromo-2-cyanobenzyl(methyl)carbamate 

[1]Patent:WO2015/89337,2015,A1.Locationinpatent:Paragraph0456

Literature
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SDS
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