Home Quinolines 53661-31-7
53661-31-7,MFCD00822620
Catalog No.:AA00DD10

53661-31-7 | 3-Oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile

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1g
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$245.00   $172.00
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5g
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$978.00   $685.00
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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:
AA00DD10
Chemical Name:
3-Oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
CAS Number:
53661-31-7
Molecular Formula:
C10H10N2O
Molecular Weight:
174.1992
MDL Number:
MFCD00822620
SMILES:
N#Cc1c(=O)[nH]cc2c1CCCC2
Properties
Computed Properties
 
Complexity:
368  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
XLogP3:
0.6  

Downstream Synthesis Route

[1]Guss,L.T.;Ershov,L.V.;Bogdanova,G.A.;Granik,V.G.[ChemistryofHeterocyclicCompounds,1990,vol.26,#2,p.183-188][KhimiyaGeterotsiklicheskikhSoedinenii,1990,vol.26,#2,p.215-220]

[1]Guss,L.T.;Ershov,L.V.;Bogdanova,G.A.;Granik,V.G.[ChemistryofHeterocyclicCompounds,1990,vol.26,#2,p.183-188][KhimiyaGeterotsiklicheskikhSoedinenii,1990,vol.26,#2,p.215-220]

[1]Guss,L.T.;Ershov,L.V.;Bogdanova,G.A.;Granik,V.G.[ChemistryofHeterocyclicCompounds,1990,vol.26,#2,p.183-188][KhimiyaGeterotsiklicheskikhSoedinenii,1990,vol.26,#2,p.215-220]

[1]Guss,L.T.;Ershov,L.V.;Bogdanova,G.A.;Granik,V.G.[ChemistryofHeterocyclicCompounds,1990,vol.26,#2,p.183-188][KhimiyaGeterotsiklicheskikhSoedinenii,1990,vol.26,#2,p.215-220]

[1]Azimov,V.A.;Granik,V.G.;Grizik,S.I.;Ershov,L.V.;Smetskaya,N.I.;etal.[PharmaceuticalChemistryJournal,1985,vol.19,#8,p.548-553][Khimiko-FarmatsevticheskiiZhurnal,1985,vol.19,#8,p.947-952]

Literature
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Tags:53661-31-7 Molecular Formula|53661-31-7 MDL|53661-31-7 SMILES|53661-31-7 3-Oxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonitrile