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512809-16-4,MFCD03419336
Catalog No.:AA00DXJA

512809-16-4 | 5-(Ethoxycarbonyl)-1-methyl-1h-pyrazole-3-carboxylic acid

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250mg
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$193.00   $135.00
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1g
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$479.00   $335.00
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  • Technical Information
  • Properties
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Technical Information
Catalog Number:
AA00DXJA
Chemical Name:
5-(Ethoxycarbonyl)-1-methyl-1h-pyrazole-3-carboxylic acid
CAS Number:
512809-16-4
Molecular Formula:
C8H10N2O4
Molecular Weight:
198.1760
MDL Number:
MFCD03419336
SMILES:
Cn1nc(cc1C(=O)OCC)C(=O)O
Properties
Computed Properties
 
Complexity:
244  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
0.6  

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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SDS
Tags:512809-16-4 Molecular Formula|512809-16-4 MDL|512809-16-4 SMILES|512809-16-4 5-(Ethoxycarbonyl)-1-methyl-1h-pyrazole-3-carboxylic acid