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119389-05-8,MFCD10574892
Catalog No.:AA000IL8

119389-05-8 | 4-Phenylethynylphthalic anhydride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$12.00   $8.00
- +
5g
97%
in stock  
$53.00   $37.00
- +
10g
95%
in stock  
$100.00   $70.00
- +
25g
95%
in stock  
$239.00   $167.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA000IL8
Chemical Name:
4-Phenylethynylphthalic anhydride
CAS Number:
119389-05-8
Molecular Formula:
C16H8O3
Molecular Weight:
248.2329
MDL Number:
MFCD10574892
SMILES:
O=C1OC(=O)c2c1cc(C#Cc1ccccc1)cc2
Properties
Properties
 
BP:
466.881 °C at 760 mmHg  
Form:
Solid  
MP:
152 °C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
447  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
3.3  

Literature

Title: 5-(2-Phenyl-ethyn-yl)isobenzofuran-1,3-dione.

Journal: Acta crystallographica. Section E, Structure reports online 20081101

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