Home Nitro Compounds 279242-11-4
279242-11-4,MFCD03700807
Catalog No.:AA00BI8R

279242-11-4 | 1-tert-Butyl-4-(4-nitrophenyl)benzene

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1g
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5g
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BI8R
Chemical Name:
1-tert-Butyl-4-(4-nitrophenyl)benzene
CAS Number:
279242-11-4
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
MDL Number:
MFCD03700807
SMILES:
[O-][N+](=O)c1ccc(cc1)c1ccc(cc1)C(C)(C)C
Properties
Computed Properties
 
Complexity:
300  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
5.5  

Downstream Synthesis Route
586-78-7   
C16H27BO2 
  279242-11-4 

[1]Klein,Markus;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2000,vol.467,#1,p.69-82]

[1]Glende,Carsten;Klein,Markus;Schmitt,Heimo;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2002,vol.515,#1-2,p.15-38]

[2]Klein,Markus;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2000,vol.467,#1,p.69-82]

[3]CurrentPatentAssignee:ELILILLY&CO-US2008/300308,2008,A1Locationinpatent:Page/Pagecolumn12

[4]Chen,Tao;Li,Wen-Qin;Liu,Zheng;Jiang,Wen;Liu,Tian;Yang,Qing;Zhu,Xiao-Lei;Yang,Guang-Fu[JournalofAgriculturalandFoodChemistry,2021,vol.69,#40,p.12039-12047]

279242-11-4   
4'-tert-butyl-4-hydroxylaminobiphenyl 

[1]Haack,Torsten;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2001,vol.491,#1-2,p.183-193]

[1]Glende,Carsten;Klein,Markus;Schmitt,Heimo;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2002,vol.515,#1-2,p.15-38]

[1]Klein,Markus;Erdinger,Lothar;Boche,Gernot[MutationResearch-GeneticToxicologyandEnvironmentalMutagenesis,2000,vol.467,#1,p.69-82]

Literature
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SDS
Tags:279242-11-4 Molecular Formula|279242-11-4 MDL|279242-11-4 SMILES|279242-11-4 1-tert-Butyl-4-(4-nitrophenyl)benzene