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62718-31-4,MFCD01540574
Catalog No.:AA00EFAJ

62718-31-4 | 1-Benzylpiperidine-4-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$26.00   $18.00
- +
5g
97%
in stock  
$55.00   $39.00
- +
10g
97%
in stock  
$101.00   $71.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EFAJ
Chemical Name:
1-Benzylpiperidine-4-carbonitrile
CAS Number:
62718-31-4
Molecular Formula:
C13H16N2
Molecular Weight:
200.2795
MDL Number:
MFCD01540574
SMILES:
N#CC1CCN(CC1)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
226  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2  

Upstream Synthesis Route

[1]Patent:WO2007/7072,2007,A1,.Locationinpatent:Page/Pagecolumn53-54

[2]Patent:WO2005/61483,2005,A2,.Locationinpatent:Page/Pagecolumn52

[3]Synthesis(Germany),2015,vol.47,#23,p.3758-3766

[4]JournalofMedicinalChemistry,1983,vol.26,#10,p.1433-1438

[5]Patent:WO2004/2483,2004,A1,.Locationinpatent:Page/Pagecolumn21;42-43;45

[6]Patent:US6498159,2002,B1,

[7]JournaloftheAmericanChemicalSociety,2010,vol.132,#29,p.10024-10026

[1]OrganicLetters,2016,vol.18,#5,p.988-991

[2]Patent:WO2008/34731,2008,A1,.Locationinpatent:Page/Pagecolumn40;66

[3]Patent:WO2008/34731,2008,A1,.Locationinpatent:Page/Pagecolumn40;66

[1]Synthesis(Germany),2015,vol.47,#23,p.3758-3766

[1]OrganicProcessResearchandDevelopment,2012,vol.16,#12,p.1927-1939

[1]TetrahedronLetters,1989,vol.30,#28,p.3681-3684

[2]JournalofOrganicChemistry,1991,vol.56,#5,p.1827-1832

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,1983,vol.26,p.1433-1438

[1]JournalofMedicinalChemistry,1983,vol.26,p.1433-1438

[1]JournalofMedicinalChemistry,1983,vol.26,p.1433-1438

[1]JournalofMedicinalChemistry,1983,vol.26,p.1433-1438

62718-31-4    931-50-0   
(1-Benzyl-piperidin-4-yl)-cyclohexyl-methanone 

[1]JournalofMedicinalChemistry,1983,vol.26,p.1433-1438

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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