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215868-81-8,MFCD09966168
Catalog No.:AA007PTO

215868-81-8 | (1-Ethyl-1H-1,2,4-triazol-5-yl)methanol

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1g
95%
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$247.00   $173.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007PTO
Chemical Name:
(1-Ethyl-1H-1,2,4-triazol-5-yl)methanol
CAS Number:
215868-81-8
Molecular Formula:
C5H9N3O
Molecular Weight:
127.1445
MDL Number:
MFCD09966168
SMILES:
OCc1ncnn1CC
Properties
Computed Properties
 
Complexity:
88.3  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
-0.5  

Downstream Synthesis Route
215868-81-8   
N-14C-2-fluorobenzylidene-N'-(3-chloro-4-(1,1-dimethyleth-1-yl)pyridazin-6-yl)hydrazine 
 
14C-TPA023 

[1]Atack,JohnR.;Wafford,KeithA.;Tye,SpencerJ.;Cook,SusanM.;Sohal,Bindi;Pike,Andrew;Sur,Cyrille;Melillo,David;Bristow,Linda;Bromidge,Fran;Ragan,Ian;Kerby,Julie;Street,Les;Carling,Robert;Castro,JoseL.;Whiting,Paul;Dawson,GerardR.;McKernan,RuthM.[JournalofPharmacologyandExperimentalTherapeutics,2006,vol.316,#1,p.410-422]

215868-81-8    252977-54-1   
TPA023 

[1]Carling,RobertW.;Madin,Andrew;Guiblin,Alec;Russell,MichaelG.N.;Moore,KevinW.;Mitchinson,Andrew;Sohal,Bindi;Pike,Andrew;Cook,SusanM.;Ragan,IanC.;McKernan,RuthM.;Quirk,Kathleen;Ferris,Pushpinder;Marshall,George;Thompson,SallyAnn;Wafford,KeithA.;Dawson,GerardR.;Atack,JohnR.;Harrison,Timothy;Castro,JoséL.;Street,LeslieJ.[JournalofMedicinalChemistry,2005,vol.48,#23,p.7089-7092]

[2]CurrentPatentAssignee:MERCK&COINC-US6630471,2003,B1

[1]JournalofMedicinalChemistry,2005,vol.48,p.7089-7092

215868-81-8    350578-66-4   
3-<i>tert</i>-butyl-2-(2-ethyl-2<i>H</i>-1,2,4triazol-3-ylmethoxy)-8-phenyl-1,2-dihydro-pyrazino2,3-<i>d</i>pyridazine 

[1]Mitchinson,Andrew;Blackaby,WesleyP.;Bourrain,Sylvie;Carling,RobertW.;Lewis,RichardT.[TetrahedronLetters,2006,vol.47,#13,p.2257-2260]

215868-81-8    350578-65-3   
2-(2-ethyl-2<i>H</i>-1,2,4triazol-3-ylmethoxy)-3-furan-2-yl-8-phenyl-1,2-dihydro-pyrazino2,3-<i>d</i>pyridazine 

[1]Mitchinson,Andrew;Blackaby,WesleyP.;Bourrain,Sylvie;Carling,RobertW.;Lewis,RichardT.[TetrahedronLetters,2006,vol.47,#13,p.2257-2260]

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Tags:215868-81-8 Molecular Formula|215868-81-8 MDL|215868-81-8 SMILES|215868-81-8 (1-Ethyl-1H-1,2,4-triazol-5-yl)methanol