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180741-44-0,MFCD03419599
Catalog No.:AA00227M

180741-44-0 | (5-Methyl-1h-pyrazol-1-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$204.00   $143.00
- +
1g
≥ 96% (NMR)
in stock  
$428.00   $299.00
- +
5g
≥ 96% (NMR)
in stock  
$1,792.00   $1,255.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00227M
Chemical Name:
(5-Methyl-1h-pyrazol-1-yl)acetic acid
CAS Number:
180741-44-0
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD03419599
SMILES:
OC(=O)Cn1nccc1C
Properties
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:
0.3  

Downstream Synthesis Route

[1]Morytko,MichaelJ.;Betschmann,Patrick;Woller,Kevin;Ericsson,Anna;Chen,Haipeng;Donnelly-Roberts,DianaL.;Namovic,MarianT.;Jarvis,MichaelF.;Carroll,WilliamA.;Rafferty,Paul[BioorganicandMedicinalChemistryLetters,2008,vol.18,#6,p.2093-2096]

180741-44-0   
5-(2,3-dihydro-1H-indol-5-yl)-7-methyl-7H-pyrrolo2,3-dpyrimidin-4-amine 
 
7-methyl-5-{1-(5-methyl-1H-pyrazol-1-yl)acetyl-2,3-dihydro-1H-indol-5-yl}-7H-pyrrolo2,3-dpyrimidin-4-amine 

[1]Axten,JeffreyM.;Romeril,StuartP.;Shu,Arthur;Ralph,Jeffrey;Medina,JesusR.;Feng,Yanhong;Li,WilliamHoiHong;Grant,SethW.;Heerding,DirkA.;Minthorn,Elisabeth;Mencken,Thomas;Gaul,Nathan;Goetz,Aaron;Stanley,Thomas;Hassell,AnnieM.;Gampe,RobertT.;Atkins,Charity;Kumar,Rakesh[ACSMedicinalChemistryLetters,2013,vol.4,#10,p.964-968]

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2014/57937,2014,A1Locationinpatent:Paragraph0237;0238

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2014/57937,2014,A1

Literature
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SDS
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Tags:180741-44-0 Molecular Formula|180741-44-0 MDL|180741-44-0 SMILES|180741-44-0 (5-Methyl-1h-pyrazol-1-yl)acetic acid