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113438-59-8,MFCD09954797
Catalog No.:AA0008IS

113438-59-8 | Methyl 3-(cyanomethyl)-1H-indole-5-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97+%
in stock  
$26.00   $18.00
- +
250mg
97+%
in stock  
$32.00   $22.00
- +
1g
97+%
in stock  
$124.00   $87.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0008IS
Chemical Name:
Methyl 3-(cyanomethyl)-1H-indole-5-carboxylate
CAS Number:
113438-59-8
Molecular Formula:
C12H10N2O2
Molecular Weight:
214.2200
MDL Number:
MFCD09954797
SMILES:
N#CCc1c[nH]c2c1cc(cc2)C(=O)OC
Properties
Computed Properties
 
Complexity:
320  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.6  

Downstream Synthesis Route
C11H10INO2 
  143-33-9    113438-59-8 

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1Locationinpatent:Page/Pagecolumn48-49;49

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1Locationinpatent:Page/Pagecolumn49

[2]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1Locationinpatent:Page/Pagecolumn60

[3]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2013/26162,2013,A1Locationinpatent:Page/Pagecolumn51

C11H10INO2 
  151-50-8    113438-59-8 

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1Locationinpatent:Page/Pagecolumn60

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2013/26162,2013,A1

[2]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1

[3]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1

[4]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1

[5]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2006/276496,2006,A1

887477-37-4   
potassiumcyanide 
  113438-59-8 

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2013/26162,2013,A1Locationinpatent:Page/Pagecolumn51

Literature
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SDS
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Tags:113438-59-8 Molecular Formula|113438-59-8 MDL|113438-59-8 SMILES|113438-59-8 Methyl 3-(cyanomethyl)-1H-indole-5-carboxylate