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13014-48-7,MFCD06658396
Catalog No.:AA000TZA

13014-48-7 | (4-Chloro-phenyl)-oxo-acetonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
96%
in stock  
$62.00   $44.00
- +
5g
96%
in stock  
$253.00   $177.00
- +
25g
96%
in stock  
$1,167.00   $817.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000TZA
Chemical Name:
(4-Chloro-phenyl)-oxo-acetonitrile
CAS Number:
13014-48-7
Molecular Formula:
C8H4ClNO
Molecular Weight:
165.5765
MDL Number:
MFCD06658396
SMILES:
N#CC(=O)c1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
197  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.7  

Literature

Title: Quantitative evaluation of the mechanism of electroreduction of benzoyl cyanides.

Journal: The Journal of organic chemistry 20070119

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Tags:13014-48-7 Molecular Formula|13014-48-7 MDL|13014-48-7 SMILES|13014-48-7 (4-Chloro-phenyl)-oxo-acetonitrile