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98534-82-8,MFCD03934809
Catalog No.:AA005UC9

98534-82-8 | 1-(3-Chlorophenyl)-5-(trifluoromethyl)-1h-pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$129.00   $90.00
- +
1g
97%
in stock  
$243.00   $170.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005UC9
Chemical Name:
1-(3-Chlorophenyl)-5-(trifluoromethyl)-1h-pyrazole-4-carboxylic acid
CAS Number:
98534-82-8
Molecular Formula:
C11H6ClF3N2O2
Molecular Weight:
290.6257
MDL Number:
MFCD03934809
SMILES:
Clc1cccc(c1)n1ncc(c1C(F)(F)F)C(=O)O
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
353  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3  

Downstream Synthesis Route

[1]Beck,JamesR.;Wright,FredL.[JournalofHeterocyclicChemistry,1987,vol.24,p.739-740]

[2]Wu,Zhibing;Park,Hyung-Yeon;Xie,Dewen;Yang,Jingxin;Hou,Shuaitao;Shahzad,Nasir;Kim,ChanKyung;Yang,Song[JournalofAgriculturalandFoodChemistry,2021,vol.69,#4,p.1214-1223]

[1]Beck,JamesR.;Wright,FredL.[JournalofHeterocyclicChemistry,1987,vol.24,p.739-740]

[1]Beck,JamesR.;Wright,FredL.[JournalofHeterocyclicChemistry,1987,vol.24,p.739-740]

98534-82-8   
C16H10ClF3N4O 

[1]Wu,Zhibing;Park,Hyung-Yeon;Xie,Dewen;Yang,Jingxin;Hou,Shuaitao;Shahzad,Nasir;Kim,ChanKyung;Yang,Song[JournalofAgriculturalandFoodChemistry,2021,vol.69,#4,p.1214-1223]

Literature
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SDS
Tags:98534-82-8 Molecular Formula|98534-82-8 MDL|98534-82-8 SMILES|98534-82-8 1-(3-Chlorophenyl)-5-(trifluoromethyl)-1h-pyrazole-4-carboxylic acid