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400858-54-0,MFCD02090883
Catalog No.:AA003E8Q

400858-54-0 | 1-Ethyl-1H-pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$15.00   $11.00
- +
250mg
97%
in stock  
$22.00   $15.00
- +
1g
95%
in stock  
$31.00   $22.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003E8Q
Chemical Name:
1-Ethyl-1H-pyrazole-4-carboxylic acid
CAS Number:
400858-54-0
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD02090883
SMILES:
CCn1cc(cn1)C(=O)O
Properties
Properties
 
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
138  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.1  

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:400858-54-0 Molecular Formula|400858-54-0 MDL|400858-54-0 SMILES|400858-54-0 1-Ethyl-1H-pyrazole-4-carboxylic acid