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57120-36-2,MFCD11196184
Catalog No.:AA00EICH

57120-36-2 | 4-tert-Butoxyaniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95+%
in stock  
$65.00   $45.00
- +
1g
95+%
in stock  
$143.00   $100.00
- +
5g
98%
in stock  
$520.00   $364.00
- +
10g
98%
in stock  
$774.00 $542.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EICH
Chemical Name:
4-tert-Butoxyaniline
CAS Number:
57120-36-2
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
MDL Number:
MFCD11196184
SMILES:
CC(Oc1ccc(cc1)N)(C)C
Properties
Computed Properties
 
Complexity:
131  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.9  

Downstream Synthesis Route

[1]Bowden;Green[JournaloftheChemicalSociety,1954,p.1795,1797]

[2]Kawamatsu;Asakawa;Saraie;Mizuno;Imamiya;Nishikawa;Hamuro[Arzneimittel-Forschung/DrugResearch,1980,vol.30,#5,p.751-758]

[3]Ramlall,Pratima;McClelland,RobertA.[JournaloftheChemicalSociety.PerkinTransactions2(2001),1999,#2,p.225-232]

[4]Locationinpatent:experimentalpartGujjar,Ramesh;ElMazouni,Farah;White,KarenL.;White,John;Creason,Sharon;Shackleford,DavidM.;Deng,Xiaoyi;Charman,WilliamN.;Bathurst,Ian;Burrows,Jeremy;Floyd,DavidM.;Matthews,David;Buckner,FrederickS.;Charman,SusanA.;Phillips,MargaretA.;Rathod,PradipsinhK.[JournalofMedicinalChemistry,2011,vol.54,#11,p.3935-3949]

[5]Yu,Ming-cheng;Yang,Feng;Ding,Xiao-yu;Sun,Nan-nan;Jiang,Zheng-yuan;Huang,Ya-fei;Yan,Yu-rong;Zhu,Chen;Xie,Qiong;Chen,Zhi-feng;Guo,Si-qi;Jiang,Hua-liang;Chen,Kai-xian;Luo,Cheng;Luo,Xiao-min;Chen,Shi-jie;Wang,Yong-hui[ActaPharmacologicaSinica,2021,vol.42,#9,p.1524-1534]

[1]BulletindelaSocieteChimiquedeFrance,1988,p.79-87

[1]OrganicLetters,2015,vol.17,p.5934-5937

[2]Patent:US2019/127337,2019,A1.Locationinpatent:Paragraph0266

[3]Patent:US10500577,2019,B2.Locationinpatent:Page/Pagecolumn89-90

[4]AngewandteChemie-InternationalEdition,2015,vol.54,p.3768-3772    Angew.Chem.,2015,vol.127,p.3839-3843,5

[1]Liu,Jianzhong;Wu,Kai;Shen,Tao;Liang,Yujie;Zou,Miancheng;Zhu,Yuchao;Li,Xinwei;Li,Xinyao;Jiao,Ning[Chemistry-AEuropeanJournal,2017,vol.23,#3,p.563-567]

18995-35-2    57120-36-2   
C20H27NO2 

[1]Organometallics,2017,vol.36,p.251-254

Literature
Quotation Request
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SDS
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Tags:57120-36-2 Molecular Formula|57120-36-2 MDL|57120-36-2 SMILES|57120-36-2 4-tert-Butoxyaniline
Catalog No.: AA00EICH
57120-36-2,MFCD11196184
57120-36-2 | 4-tert-Butoxyaniline
Pack Size： 250mg
Purity： 95+%
in stock
$65.00 $45.00
Pack Size： 1g
Purity： 95+%
in stock
$143.00 $100.00
Pack Size： 5g
Purity： 98%
in stock
$520.00 $364.00
Pack Size： 10g
Purity： 98%
in stock
$774.00 $542.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EICH
Chemical Name: 4-tert-Butoxyaniline
CAS Number: 57120-36-2
Molecular Formula: C10H15NO
Molecular Weight: 165.2322
MDL Number: MFCD11196184
SMILES: CC(Oc1ccc(cc1)N)(C)C
Properties
Complexity: 131  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.9  
Downstream Synthesis Route
2109-72-0    57120-36-2 

[1]Bowden;Green[JournaloftheChemicalSociety,1954,p.1795,1797]

[2]Kawamatsu;Asakawa;Saraie;Mizuno;Imamiya;Nishikawa;Hamuro[Arzneimittel-Forschung/DrugResearch,1980,vol.30,#5,p.751-758]

[3]Ramlall,Pratima;McClelland,RobertA.[JournaloftheChemicalSociety.PerkinTransactions2(2001),1999,#2,p.225-232]

[4]Locationinpatent:experimentalpartGujjar,Ramesh;ElMazouni,Farah;White,KarenL.;White,John;Creason,Sharon;Shackleford,DavidM.;Deng,Xiaoyi;Charman,WilliamN.;Bathurst,Ian;Burrows,Jeremy;Floyd,DavidM.;Matthews,David;Buckner,FrederickS.;Charman,SusanA.;Phillips,MargaretA.;Rathod,PradipsinhK.[JournalofMedicinalChemistry,2011,vol.54,#11,p.3935-3949]

[5]Yu,Ming-cheng;Yang,Feng;Ding,Xiao-yu;Sun,Nan-nan;Jiang,Zheng-yuan;Huang,Ya-fei;Yan,Yu-rong;Zhu,Chen;Xie,Qiong;Chen,Zhi-feng;Guo,Si-qi;Jiang,Hua-liang;Chen,Kai-xian;Luo,Cheng;Luo,Xiao-min;Chen,Shi-jie;Wang,Yong-hui[ActaPharmacologicaSinica,2021,vol.42,#9,p.1524-1534]

56146-83-9    57120-36-2    117765-68-1 

[1]BulletindelaSocieteChimiquedeFrance,1988,p.79-87

18995-35-2    57120-36-2 

[1]OrganicLetters,2015,vol.17,p.5934-5937

[2]Patent:US2019/127337,2019,A1.Locationinpatent:Paragraph0266

[3]Patent:US10500577,2019,B2.Locationinpatent:Page/Pagecolumn89-90

[4]AngewandteChemie-InternationalEdition,2015,vol.54,p.3768-3772    Angew.Chem.,2015,vol.127,p.3839-3843,5

6669-13-2    127517-27-5    57120-36-2 

[1]Liu,Jianzhong;Wu,Kai;Shen,Tao;Liang,Yujie;Zou,Miancheng;Zhu,Yuchao;Li,Xinwei;Li,Xinyao;Jiao,Ning[Chemistry-AEuropeanJournal,2017,vol.23,#3,p.563-567]

18995-35-2    57120-36-2   
C20H27NO2 

[1]Organometallics,2017,vol.36,p.251-254

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