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37718-11-9,MFCD00011558
Catalog No.:AA00342B

37718-11-9 | 1H-Pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$7.00   $5.00
- +
5g
98%
in stock  
$9.00   $7.00
- +
10g
98%
in stock  
$17.00   $12.00
- +
25g
98%
in stock  
$32.00   $22.00
- +
100g
98%
in stock  
$107.00   $75.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA00342B
Chemical Name:
1H-Pyrazole-4-carboxylic acid
CAS Number:
37718-11-9
Molecular Formula:
C4H4N2O2
Molecular Weight:
112.0868
MDL Number:
MFCD00011558
SMILES:
OC(=O)c1c[nH]nc1
Properties
Properties
 
BP:
417.1°C at 760 mmHg  
Form:
Solid  
MP:
227 - 228 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
104  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
-0.3  

Literature

Title: Kinetics and metabolism of fomepizole in healthy humans.

Journal: Clinical toxicology (Philadelphia, Pa.) 20120601

Title: A solid-state NMR, X-ray diffraction, and ab initio computational study of hydrogen-bond structure and dynamics of pyrazole-4-carboxylic acid chains.

Journal: Journal of the American Chemical Society 20010815

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SDS
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