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31962-35-3,MFCD00229565
Catalog No.:AA00CKUI

31962-35-3 | 1H-Pyrazole-3,4-dicarboxylic acid

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100mg
98%
1 week  
$66.00   $46.00
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250mg
98%
1 week  
$111.00   $78.00
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00CKUI
Chemical Name:
1H-Pyrazole-3,4-dicarboxylic acid
CAS Number:
31962-35-3
Molecular Formula:
C5H4N2O4
Molecular Weight:
156.0963
MDL Number:
MFCD00229565
SMILES:
OC(=O)c1[nH]ncc1C(=O)O
Properties
Computed Properties
 
Complexity:
193  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
-0.4  

Literature

Title: A novel three-dimensional heterometalliccoordination polymer:poly[[hexaaquabis[mu3-3,5-dicarboxylatopyrazolato-kappa5O3,N2:N1,O5:O50]-(mu2-oxalato-kappa4O1,O2:O10,O20)-copper(II)dierbium(III)] trihydrate].

Journal: Acta crystallographica. Section C, Crystal structure communications 20080801

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Tags:31962-35-3 Molecular Formula|31962-35-3 MDL|31962-35-3 SMILES|31962-35-3 1H-Pyrazole-3,4-dicarboxylic acid