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158115-67-4,MFCD11037367
Catalog No.:AA001PXA

158115-67-4 | 2-(4-Methylpiperidino)benzonitrile

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1g
98%
in stock  
$103.00   $73.00
- +
5g
98%
in stock  
$311.00   $218.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001PXA
Chemical Name:
2-(4-Methylpiperidino)benzonitrile
CAS Number:
158115-67-4
Molecular Formula:
C13H16N2
Molecular Weight:
200.2795
MDL Number:
MFCD11037367
SMILES:
N#Cc1ccccc1N1CCC(CC1)C
Properties
Computed Properties
 
Complexity:
245  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
3  

Downstream Synthesis Route
201230-82-2    157428-87-0   
2-(4-Methyl-3,4-dihydro-2H-pyridin-1-yl)-benzonitrile 
  158115-67-4 

[1]Anastasiou,Despina;Campi,EvaM.;Chaouk,Hassan;Fallon,GaryD.;Jackson,W.Roy;etal.[AustralianJournalofChemistry,1994,vol.47,#6,p.1043-1060]

[1]Grell,Wolfgang;Hurnaus,Rudolf[JournalofMedicinalChemistry,1998,vol.41,#26,p.5219-5246]

[1]Grell,Wolfgang;Hurnaus,Rudolf[JournalofMedicinalChemistry,1998,vol.41,#26,p.5219-5246]

[1]Möhrle;Jeandrée[ZeitschriftfurNaturforschung,B:ChemicalSciences,1999,vol.54,#12,p.1577-1588]

[1]Möhrle;Jeandrée[ZeitschriftfurNaturforschung,B:ChemicalSciences,1999,vol.54,#12,p.1577-1588]

Literature
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SDS
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Tags:158115-67-4 Molecular Formula|158115-67-4 MDL|158115-67-4 SMILES|158115-67-4 2-(4-Methylpiperidino)benzonitrile