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Home Nitro Compounds 77451-51-5
77451-51-5,MFCD00009756
Catalog No.:AA003D1E

77451-51-5 | 1-(P-Toluenesulfonyl)-3-nitro-1,2,4-triazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$18.00   $13.00
- +
5g
95%
in stock  
$35.00   $25.00
- +
100g
98%
in stock  
$652.00   $457.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003D1E
Chemical Name:
1-(P-Toluenesulfonyl)-3-nitro-1,2,4-triazole
CAS Number:
77451-51-5
Molecular Formula:
C9H8N4O4S
Molecular Weight:
268.2492
MDL Number:
MFCD00009756
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1cnc(n1)[N+](=O)[O-]
Properties
Properties
 
Form:
Solid  
MP:
133-135 °C  
Storage:
Inert atmosphere;-20 ℃;  

Computed Properties
 
Complexity:
407  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Downstream Synthesis Route

[1]JournalofOrganicChemistry,2010,vol.75,p.2722-2725

Literature
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Additional Info:
SDS
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