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21667-63-0,MFCD09756510
Catalog No.:AA00BFHE

21667-63-0 | 3-(2-Cyanoacetyl)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
97%
2 weeks  
$312.00   $219.00
- +
1g
97%
2 weeks  
$461.00   $323.00
- +
5g
97%
2 weeks  
$1,354.00   $948.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BFHE
Chemical Name:
3-(2-Cyanoacetyl)benzonitrile
CAS Number:
21667-63-0
Molecular Formula:
C10H6N2O
Molecular Weight:
170.1674
MDL Number:
MFCD09756510
SMILES:
N#CCC(=O)c1cccc(c1)C#N
Properties
Computed Properties
 
Complexity:
291  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
1  

Downstream Synthesis Route

[1]Patent:WO2015/97122,2015,A1.Locationinpatent:Page/Pagecolumn88

[1]Kumdale,PrashantGanpatrao;Shitole,NanaVikram[OrientalJournalofChemistry,2022,vol.38,#1,p.198-203]

[2]CurrentPatentAssignee:NORGINEBV-WO2015/97122,2015,A1Locationinpatent:Page/Pagecolumn88;89

[3]CurrentPatentAssignee:ADORXTHERAPEUTICS-WO2021/224636,2021,A1Locationinpatent:Paragraph001005-001007

Literature
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Additional Info:
SDS
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Tags:21667-63-0 Molecular Formula|21667-63-0 MDL|21667-63-0 SMILES|21667-63-0 3-(2-Cyanoacetyl)benzonitrile