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10199-57-2,MFCD00124910
Catalog No.:AA000648

10199-57-2 | 5-Methyl-1-phenylpyrazole-3-carboxylic acid

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Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$13.00   $9.00
- +
250mg
97%
in stock  
$29.00   $21.00
- +
1g
97%
in stock  
$61.00   $43.00
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5g
97%
in stock  
$151.00   $106.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000648
Chemical Name:
5-Methyl-1-phenylpyrazole-3-carboxylic acid
CAS Number:
10199-57-2
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD00124910
SMILES:
OC(=O)c1nn(c(c1)C)c1ccccc1
Properties
Computed Properties
 
Complexity:
239  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.2  

Downstream Synthesis Route

[1]GazzettaChimicaItaliana,1940,vol.70,p.240,244

[1]AttidellaAccademiaNazionaledeiLincei,ClassediScienzeFisiche,MatematicheeNaturali,Rendiconti,1907,vol.<5>16I,p.773

[1]JustusLiebigsAnnalenderChemie,1907,vol.352,p.328Anm.11

[2]GazzettaChimicaItaliana,1940,vol.70,p.240,244

[3]JustusLiebigsAnnalenderChemie,1894,vol.278,p.270    JustusLiebigsAnnalenderChemie,1897,vol.295,p.304,315

[1]JustusLiebigsAnnalenderChemie,1924,vol.437,p.303

[2]JournalofHeterocyclicChemistry,2003,vol.40,p.773-782

[3]EuropeanJournalofMedicinalChemistry,2016,vol.123,p.58-68

[4]Patent:CN105330644,2016,A.Locationinpatent:Paragraph0048;0049

[1]GazzettaChimicaItaliana,1940,vol.70,p.240,244

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
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