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925179-02-8,MFCD03420211
Catalog No.:AA0064W8

925179-02-8 | 1-(Difluoromethyl)-1h-pyrazole-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
in stock  
$42.00   $29.00
- +
250mg
98%
in stock  
$51.00   $36.00
- +
1g
98%
in stock  
$148.00   $104.00
- +
5g
98%
in stock  
$648.00   $454.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0064W8
Chemical Name:
1-(Difluoromethyl)-1h-pyrazole-3-carboxylic acid
CAS Number:
925179-02-8
Molecular Formula:
C5H4F2N2O2
Molecular Weight:
162.0943
MDL Number:
MFCD03420211
SMILES:
OC(=O)c1ccn(n1)C(F)F
Properties
Properties
 
BP:
273.7±40.0 °C(Predicted)  
Form:
Solid  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
165  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.9  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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Tags:925179-02-8 Molecular Formula|925179-02-8 MDL|925179-02-8 SMILES|925179-02-8 1-(Difluoromethyl)-1h-pyrazole-3-carboxylic acid