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124499-37-2,MFCD09037894
Catalog No.:AA000M12

124499-37-2 | 1,4-Dioxaspiro[4.5]decane-8-acetonitrile

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250mg
95%
in stock  
$257.00   $180.00
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1g
98%
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$1,009.00   $706.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000M12
Chemical Name:
1,4-Dioxaspiro[4.5]decane-8-acetonitrile
CAS Number:
124499-37-2
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
MDL Number:
MFCD09037894
SMILES:
N#CCC1CCC2(CC1)OCCO2
Properties
Computed Properties
 
Complexity:
214  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
0.8  

Downstream Synthesis Route

[1]Nugent,ThomasC.;Najafian,FoadTehrani;Hussein,HusseinAliElDamrany;Hussain,Ishtiaq[Chemistry-AEuropeanJournal,2016,vol.22,#40,p.14342-14348]

[2]Locationinpatent:schemeortableRew,Yosup;McMinn,DustinL.;Wang,Zhulun;He,Xiao;Hungate,RandallW.;Jaen,JuanC.;Sudom,Athena;Sun,Daqing;Tu,Hua;Ursu,Stefania;Villemure,Elisia;Walker,NigelP.C.;Yan,Xuelei;Ye,Qiuping;Powers,JayP.[BioorganicandMedicinalChemistryLetters,2009,vol.19,#6,p.1797-1801]

[3]Yamamoto,Takayoshi;Eki,Toshiko;Nagumo,Shinji;Suemune,Hiroshi;Sakai,Kiyoshi[Tetrahedron,1992,vol.48,#22,p.4517-4524]

[4]Alonso,Francisco;Mico,Irene;Najera,Carmen;Sansano,JoseM.;Yus,Miguel;etal.[Tetrahedron,1995,vol.51,#37,p.10259-10280]

[5]CurrentPatentAssignee:ELILILLY&CO-US6174922,2001,B1

[1]Locationinpatent:schemeortableRew,Yosup;McMinn,DustinL.;Wang,Zhulun;He,Xiao;Hungate,RandallW.;Jaen,JuanC.;Sudom,Athena;Sun,Daqing;Tu,Hua;Ursu,Stefania;Villemure,Elisia;Walker,NigelP.C.;Yan,Xuelei;Ye,Qiuping;Powers,JayP.[BioorganicandMedicinalChemistryLetters,2009,vol.19,#6,p.1797-1801]

[2]Alonso,Francisco;Mico,Irene;Najera,Carmen;Sansano,JoseM.;Yus,Miguel;etal.[Tetrahedron,1995,vol.51,#37,p.10259-10280]

[1]JournalofMedicinalChemistry,1993,vol.36,p.683-689

Literature
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SDS
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Tags:124499-37-2 Molecular Formula|124499-37-2 MDL|124499-37-2 SMILES|124499-37-2 1,4-Dioxaspiro[4.5]decane-8-acetonitrile