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956352-96-8,MFCD04970957
Catalog No.:AA00IJ73

956352-96-8 | 3-(1,3,5-Trimethyl-1h-pyrazol-4-yl)propanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$145.00   $102.00
- +
5g
95%
in stock  
$411.00   $288.00
- +
10g
95%
in stock  
$710.00   $497.00
- +
25g
95%
in stock  
$1,407.00   $985.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IJ73
Chemical Name:
3-(1,3,5-Trimethyl-1h-pyrazol-4-yl)propanoic acid
CAS Number:
956352-96-8
Molecular Formula:
C9H14N2O2
Molecular Weight:
182.2197
MDL Number:
MFCD04970957
SMILES:
OC(=O)CCc1c(C)nn(c1C)C
Properties
Computed Properties
 
Complexity:
196  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Rackham,MarkD.;Brannigan,JamesA.;Rangachari,Kaveri;Meister,Stephan;Wilkinson,AnthonyJ.;Holder,AnthonyA.;Leatherbarrow,RobinJ.;Tate,EdwardW.[JournalofMedicinalChemistry,2014,vol.57,#6,p.2773-2788]

[1]Rackham,MarkD.;Brannigan,JamesA.;Rangachari,Kaveri;Meister,Stephan;Wilkinson,AnthonyJ.;Holder,AnthonyA.;Leatherbarrow,RobinJ.;Tate,EdwardW.[JournalofMedicinalChemistry,2014,vol.57,#6,p.2773-2788]

[1]Rackham,MarkD.;Brannigan,JamesA.;Rangachari,Kaveri;Meister,Stephan;Wilkinson,AnthonyJ.;Holder,AnthonyA.;Leatherbarrow,RobinJ.;Tate,EdwardW.[JournalofMedicinalChemistry,2014,vol.57,#6,p.2773-2788]

[1]Rackham,MarkD.;Brannigan,JamesA.;Rangachari,Kaveri;Meister,Stephan;Wilkinson,AnthonyJ.;Holder,AnthonyA.;Leatherbarrow,RobinJ.;Tate,EdwardW.[JournalofMedicinalChemistry,2014,vol.57,#6,p.2773-2788]

[1]Rackham,MarkD.;Brannigan,JamesA.;Rangachari,Kaveri;Meister,Stephan;Wilkinson,AnthonyJ.;Holder,AnthonyA.;Leatherbarrow,RobinJ.;Tate,EdwardW.[JournalofMedicinalChemistry,2014,vol.57,#6,p.2773-2788]

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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Tags:956352-96-8 Molecular Formula|956352-96-8 MDL|956352-96-8 SMILES|956352-96-8 3-(1,3,5-Trimethyl-1h-pyrazol-4-yl)propanoic acid