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1258650-37-1,MFCD17167170
Catalog No.:AA01AACK

1258650-37-1 | 3-(methoxycarbonyl)-1-phenyl-1H-pyrazole-5-carboxylic acid

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  • Technical Information
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Technical Information
Catalog Number:
AA01AACK
Chemical Name:
3-(methoxycarbonyl)-1-phenyl-1H-pyrazole-5-carboxylic acid
CAS Number:
1258650-37-1
Molecular Formula:
C12H10N2O4
Molecular Weight:
246.2188
MDL Number:
MFCD17167170
SMILES:
COC(=O)c1nn(c(c1)C(=O)O)c1ccccc1
Properties
Computed Properties
 
Complexity:
328  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.9  

Literature
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Additional Info:
SDS
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Tags:1258650-37-1 Molecular Formula|1258650-37-1 MDL|1258650-37-1 SMILES|1258650-37-1 3-(methoxycarbonyl)-1-phenyl-1H-pyrazole-5-carboxylic acid