50712-69-1,MFCD09909826
Catalog No.:AA00DHSF

50712-69-1 | 2-(Bromomethyl)-5-chlorobenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$35.00   $25.00
- +
1g
95%
in stock  
$94.00   $66.00
- +
5g
95%
in stock  
$286.00   $200.00
- +
25g
98%
in stock  
$1,218.00 $853.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DHSF
Chemical Name:
2-(Bromomethyl)-5-chlorobenzonitrile
CAS Number:
50712-69-1
Molecular Formula:
C8H5BrClN
Molecular Weight:
230.4890
MDL Number:
MFCD09909826
SMILES:
N#Cc1cc(Cl)ccc1CBr
Properties
Computed Properties
 
Complexity:
174  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Upstream Synthesis Route

[1]Patent:US2012/289497,2012,A1,.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2524917,2012,A1,.Locationinpatent:Page/Pagecolumn30-31

[3]Patent:EP2570125,2013,A1,.Locationinpatent:Paragraph0136;0137

[4]Patent:WO2013/37960,2013,A1,.Locationinpatent:Page/Pagecolumn71

[5]Arzneimittel-Forschung/DrugResearch,1973,vol.23,#8,p.1090-1100

[6]Patent:WO2006/88920,2006,A1,.Locationinpatent:Page/Pagecolumn144

[7]Patent:EP1956009,2008,A1,.Locationinpatent:Page/Pagecolumn94

Downstream Synthesis Route
50712-69-1    143-33-9   
5-chloro-2-(cyanomethyl)benzonitrile 
  76519-93-2 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

50712-69-1    143-33-9   
5-amino-11-cyano-3,8-dichloro-11-(2-cyano-4-chlorobenzyl)-11H-indeno<1,2-c>isoquinoline 
 
2-cyano-1,2,3-tris(2-cyano-4-chlorophenyl)propane 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[1]Patent:US2012/289497,2012,A1.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2524917,2012,A1.Locationinpatent:Page/Pagecolumn30-31

[3]Patent:EP2570125,2013,A1.Locationinpatent:Paragraph0136;0137

[4]Patent:WO2013/37960,2013,A1.Locationinpatent:Page/Pagecolumn71

[5]Arzneimittel-Forschung/DrugResearch,1973,vol.23,p.1090-1100

[6]Patent:WO2006/88920,2006,A1.Locationinpatent:Page/Pagecolumn144

[7]Patent:EP1956009,2008,A1.Locationinpatent:Page/Pagecolumn94

50712-69-1   
3,8-Dichloro-11H-indeno1,2-cisoquinolin-5-ylamine 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

50712-69-1   
N-(3,8-Dichloro-11-cyano-5H-indeno1,2-cisoquinolin-5-yl)-acetamide 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

Literature
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Additional Info:
SDS
Related Products of 50712-69-1
Tags:50712-69-1 Molecular Formula|50712-69-1 MDL|50712-69-1 SMILES|50712-69-1 2-(Bromomethyl)-5-chlorobenzonitrile
Catalog No.: AA00DHSF
50712-69-1,MFCD09909826
50712-69-1 | 2-(Bromomethyl)-5-chlorobenzonitrile
Pack Size: 250mg
Purity: 95%
in stock
$35.00 $25.00
Pack Size: 1g
Purity: 95%
in stock
$94.00 $66.00
Pack Size: 5g
Purity: 95%
in stock
$286.00 $200.00
Pack Size: 25g
Purity: 98%
in stock
$1,218.00 $853.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00DHSF
Chemical Name: 2-(Bromomethyl)-5-chlorobenzonitrile
CAS Number: 50712-69-1
Molecular Formula: C8H5BrClN
Molecular Weight: 230.4890
MDL Number: MFCD09909826
SMILES: N#Cc1cc(Cl)ccc1CBr
Properties
Complexity: 174  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
Upstream Synthesis Route
50712-70-4    50712-69-1 

[1]Patent:US2012/289497,2012,A1,.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2524917,2012,A1,.Locationinpatent:Page/Pagecolumn30-31

[3]Patent:EP2570125,2013,A1,.Locationinpatent:Paragraph0136;0137

[4]Patent:WO2013/37960,2013,A1,.Locationinpatent:Page/Pagecolumn71

[5]Arzneimittel-Forschung/DrugResearch,1973,vol.23,#8,p.1090-1100

[6]Patent:WO2006/88920,2006,A1,.Locationinpatent:Page/Pagecolumn144

[7]Patent:EP1956009,2008,A1,.Locationinpatent:Page/Pagecolumn94

Downstream Synthesis Route
50712-69-1    143-33-9   
5-chloro-2-(cyanomethyl)benzonitrile 
  76519-93-2 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

50712-69-1    143-33-9   
5-amino-11-cyano-3,8-dichloro-11-(2-cyano-4-chlorobenzyl)-11H-indeno<1,2-c>isoquinoline 
 
2-cyano-1,2,3-tris(2-cyano-4-chlorophenyl)propane 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

50712-70-4    50712-69-1 

[1]Patent:US2012/289497,2012,A1.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2524917,2012,A1.Locationinpatent:Page/Pagecolumn30-31

[3]Patent:EP2570125,2013,A1.Locationinpatent:Paragraph0136;0137

[4]Patent:WO2013/37960,2013,A1.Locationinpatent:Page/Pagecolumn71

[5]Arzneimittel-Forschung/DrugResearch,1973,vol.23,p.1090-1100

[6]Patent:WO2006/88920,2006,A1.Locationinpatent:Page/Pagecolumn144

[7]Patent:EP1956009,2008,A1.Locationinpatent:Page/Pagecolumn94

50712-69-1   
3,8-Dichloro-11H-indeno1,2-cisoquinolin-5-ylamine 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

[2]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

50712-69-1   
N-(3,8-Dichloro-11-cyano-5H-indeno1,2-cisoquinolin-5-yl)-acetamide 

[1]BulletinoftheChemicalSocietyofJapan,1980,vol.53,p.2885-2890

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