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1223267-19-3,MFCD14705593
Catalog No.:AA019XOX

1223267-19-3 | 4-(2-hydroxyethyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylic acid

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Technical Information
Catalog Number:
AA019XOX
Chemical Name:
4-(2-hydroxyethyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylic acid
CAS Number:
1223267-19-3
Molecular Formula:
C13H14N2O4
Molecular Weight:
262.2613
MDL Number:
MFCD14705593
SMILES:
OCCc1c([nH]n(c1=O)c1ccc(cc1)C)C(=O)O
Properties
Computed Properties
 
Complexity:
411  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
1.2  

Literature
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Additional Info:
SDS
Tags:1223267-19-3 Molecular Formula|1223267-19-3 MDL|1223267-19-3 SMILES|1223267-19-3 4-(2-hydroxyethyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrazole-3-carboxylic acid