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52805-36-4,MFCD00079701
Catalog No.:AA003KQU

52805-36-4 | 4-(Benzyloxy)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%(GC)
in stock  
$24.00   $17.00
- +
5g
98%
in stock  
$33.00   $23.00
- +
25g
98%
in stock  
$61.00   $43.00
- +
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  • Technical Information
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Technical Information
Catalog Number:
AA003KQU
Chemical Name:
4-(Benzyloxy)benzonitrile
CAS Number:
52805-36-4
Molecular Formula:
C14H11NO
Molecular Weight:
209.2432
MDL Number:
MFCD00079701
SMILES:
N#Cc1ccc(cc1)OCc1ccccc1
Properties
Properties
 
BP:
374°C at 760 mmHg  
Form:
Solid  
MP:
94 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
241  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
3.5  

Literature

Title: Thermodynamics, kinetics, and dynamics of the two alternative aniomesolytic fragmentations of C-O bonds: an electrochemical and theoretical study.

Journal: Journal of the American Chemical Society 20020501

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