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149739-51-5,MFCD09860597
Catalog No.:AA001LW3

149739-51-5 | 3-(1H-Pyrazol-5-yl)benzonitrile

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250mg
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1g
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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:
AA001LW3
Chemical Name:
3-(1H-Pyrazol-5-yl)benzonitrile
CAS Number:
149739-51-5
Molecular Formula:
C10H7N3
Molecular Weight:
169.1827
MDL Number:
MFCD09860597
SMILES:
N#Cc1cccc(c1)c1n[nH]cc1
Properties
Computed Properties
 
Complexity:
218  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.6  

Downstream Synthesis Route

[1]Tanaka,Akira;Terasawa,Takeshi;Hagihara,Hiroyuki;Kinoshita,Takayoshi;Sakuma,Yuri;Ishibe,Noriko;Sawada,Masae;Takasugi,Hisashi;Tanaka,Hirokazu[BioorganicandMedicinalChemistryLetters,1998,vol.8,#1,p.81-86]

[2]Tanaka,Akira;Terasawa,Takeshi;Hagihara,Hiroyuki;Sakuma,Yuri;Ishibe,Noriko;Sawada,Masae;Takasugi,Hisashi;Tanaka,Hirokazu[JournalofMedicinalChemistry,1998,vol.41,#13,p.2390-2410]

[1]CurrentPatentAssignee:YUMANITYTHERAPEUTICSINC-WO2021/247841,2021,A1Locationinpatent:Page/Pagecolumn57-57

[2]CurrentPatentAssignee:YUMANITYTHERAPEUTICSINC-WO2021/247841,2021,A1Locationinpatent:Page/Pagecolumn57-57

[3]CurrentPatentAssignee:YUMANITYTHERAPEUTICSINC-WO2021/247841,2021,A1Locationinpatent:Page/Pagecolumn57-57

Literature
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SDS
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