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13745-58-9,MFCD19228349
Catalog No.:AA00138D

13745-58-9 | 1,4-Dimethyl-1H-pyrazole-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$273.00   $191.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00138D
Chemical Name:
1,4-Dimethyl-1H-pyrazole-5-carboxylic acid
CAS Number:
13745-58-9
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD19228349
SMILES:
OC(=O)c1c(C)cnn1C
Properties
Computed Properties
 
Complexity:
149  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.5  

Downstream Synthesis Route

[1]CurrentPatentAssignee:IDEAYABIOSCIENCESINC.-WO2019/18562,2019,A1Locationinpatent:Paragraph0570;0696

[2]Huppatz;Phillips;Witrzens[AgriculturalandBiologicalChemistry,1984,vol.48,#1,p.45-50]

[3]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-US2009/137595,2009,A1

[4]v.Auwers;Ungemach[ChemischeBerichte,1933,vol.66,p.1209]

[1]Rojahn[ChemischeBerichte,1926,vol.59,p.609]

[1]Huppatz;Phillips;Witrzens[AgriculturalandBiologicalChemistry,1984,vol.48,#1,p.45-50]

[1]Rojahn[ChemischeBerichte,1926,vol.59,p.609]

Literature
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SDS
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Tags:13745-58-9 Molecular Formula|13745-58-9 MDL|13745-58-9 SMILES|13745-58-9 1,4-Dimethyl-1H-pyrazole-5-carboxylic acid