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175277-11-9,MFCD00173812
Catalog No.:AA0020PR

175277-11-9 | 3-(tert-Butyl)-1-methyl-1h-pyrazole-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$16.00   $11.00
- +
1g
97%
in stock  
$21.00   $15.00
- +
5g
97%
in stock  
$51.00   $36.00
- +
10g
97%
in stock  
$91.00   $64.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0020PR
Chemical Name:
3-(tert-Butyl)-1-methyl-1h-pyrazole-5-carboxylic acid
CAS Number:
175277-11-9
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
MDL Number:
MFCD00173812
SMILES:
OC(=O)c1cc(nn1C)C(C)(C)C
Properties
Properties
 
BP:
317.7°C at 760 mmHg  
Form:
Solid  
MP:
151 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
210  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Upstream Synthesis Route

[1]JournalofOrganicChemistry,1997,vol.62,#17,p.5908-5919

[2]Patent:WO2009/71706,2009,A1,.Locationinpatent:Page/Pagecolumn43-44

[3]Patent:US2011/218197,2011,A1,.Locationinpatent:Page/Pagecolumn44

[4]Patent:US2012/202856,2012,A1,.Locationinpatent:Page/Pagecolumn22

[1]JournalofOrganicChemistry,1997,vol.62,#17,p.5908-5919

[2]Patent:US2011/218197,2011,A1,

[3]Patent:US2012/202856,2012,A1,

Downstream Synthesis Route
75-97-8   
hydrazinehydrochloride 
  175277-11-9 

[1]JournalofOrganicChemistry,1997,vol.62,p.5908-5919

[1]JournalofOrganicChemistry,1997,vol.62,p.5908-5919

[2]Patent:US2011/218197,2011,A1

[3]Patent:US2012/202856,2012,A1

175277-11-9   
5-tert-Butyl-2-methyl-2H-pyrazole-3-carboxylicacidphenylamide 

[1]JournalofOrganicChemistry,1997,vol.62,p.5908-5919

175277-11-9   
5-tert-Butyl-2-methyl-2H-pyrazole-3-carboxylicacid(3-methoxy-phenyl)-amide 

[1]JournalofOrganicChemistry,1997,vol.62,p.5908-5919

175277-11-9   
5-tert-Butyl-2-methyl-2H-pyrazole-3-carboxylicacid(3-acetyl-phenyl)-amide 

[1]JournalofOrganicChemistry,1997,vol.62,p.5908-5919

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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