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52756-36-2,MFCD09966032
Catalog No.:AA00DLUF

52756-36-2 | 4-tert-Butyl-3-chloroaniline

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Purity
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Price(USD)
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250mg
95%
in stock  
$21.00   $15.00
- +
1g
95%
in stock  
$46.00   $32.00
- +
5g
95%
in stock  
$93.00   $65.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00DLUF
Chemical Name:
4-tert-Butyl-3-chloroaniline
CAS Number:
52756-36-2
Molecular Formula:
C10H14ClN
Molecular Weight:
183.6779
MDL Number:
MFCD09966032
SMILES:
Nc1ccc(c(c1)Cl)C(C)(C)C
Properties
Computed Properties
 
Complexity:
150  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
3.5  

Downstream Synthesis Route

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-EP3018123,2016,A1Locationinpatent:Paragraph0482

[2]CurrentPatentAssignee:ACTIONMEDICALTECHNOLOGIES-TW2016/2105,2016,ALocationinpatent:Paragraph0582

[3]Shirai,Junya;Tomata,Yoshihide;Kono,Mitsunori;Ochida,Atsuko;Fukase,Yoshiyuki;Sato,Ayumu;Masada,Shinichi;Kawamoto,Tetsuji;Yonemori,Kazuko;Koyama,Ryoukichi;Nakagawa,Hideyuki;Nakayama,Masaharu;Uga,Keiko;Shibata,Akira;Koga,Keiko;Okui,Toshitake;Shirasaki,Mikio;Skene,Robert;Sang,BiChing;Hoffman,Isaac;Lane,Wes;Fujitani,Yasushi;Yamasaki,Masashi;Yamamoto,Satoshi[BioorganicandMedicinalChemistry,2018,vol.26,#2,p.483-500]

[4]CurrentPatentAssignee:CHEMOCENTRYXINC-US2013/225580,2013,A1Locationinpatent:Paragraph0220;0222

[5]CurrentPatentAssignee:CHEMOCENTRYXINC-US2018/9797,2018,A1Locationinpatent:Paragraph0218;0221

[6]Siu,Tony;Altman,MichaelD.;Baltus,GretchenA.;Childers,Matthew;Ellis,J.Michael;Gunaydin,Hakan;Hatch,Harold;Ho,Thu;Jewell,James;Lacey,BrianM.;Lesburg,CharlesA.;Pan,Bo-Sheng;Sauvagnat,Berengere;Schroeder,GottfriedK.;Xu,Serena[ACSMedicinalChemistryLetters,2019,vol.10,#1,p.92-97]

[7]CurrentPatentAssignee:PFIZERINC-US2006/100460,2006,A1Locationinpatent:Page/Pagecolumn26

[8]Buckingham,Faye;Calderwood,Samuel;Checa,Begoña;Keller,Thomas;Tredwell,Matthew;Collier,ThomasLee;Newington,IanM.;Bhalla,Rajiv;Glaser,Matthias;Gouverneur,Véronique[JournalofFluorineChemistry,2015,vol.180,p.33-39]

[9]Ruechardt,C.;Eichler,S.[ChemischeBerichte,1962,vol.95,p.1921-1942]

[1]Ruechardt,C.;Eichler,S.[ChemischeBerichte,1962,vol.95,p.1921-1942]

52756-36-2    124-63-0   
N-(4-tert-Butyl-3-chloro-phenyl)-methanesulfonamide 

[1]Bromidge,StevenM.;Dabbs,Steven;Davies,DavidT.;Duckworth,D.Malcolm;Forbes,IanT.;Ham,Peter;Jones,GrahamE.;King,FrankD.;Saunders,DamianV.;Starr,Susannah;Thewlis,KevinM.;Wyman,PaulA.;Blaney,FrankE.;Naylor,ChristopherB.;Bailey,Fiona;Blackburn,ThomasP.;Holland,Vicky;Kennett,GuyA.;Riley,GrahamJ.;Wood,MartynD.[JournalofMedicinalChemistry,1998,vol.41,#10,p.1598-1612]

52756-36-2    15268-31-2   
1-(4-<i>tert</i>-butyl-3-chloro-phenyl)-3-pyridin-3-yl-urea 

[1]Bromidge,StevenM.;Dabbs,Steven;Davies,DavidT.;Davies,Susannah;Duckworth,D.Malcolm;Forbes,IanT.;Gadre,Angela;Ham,Peter;Jones,GrahamE.;King,FrankD.;Saunders,DamianV.;Thewlis,KevinM.;Vyas,Deepa;Blackburn,ThomasP.;Holland,Vicky;Kennett,GuyA.;Riley,GrahamJ.;Wood,MartynD.[BioorganicandMedicinalChemistry,1999,vol.7,#12,p.2767-2773]

Literature
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Tags:52756-36-2 Molecular Formula|52756-36-2 MDL|52756-36-2 SMILES|52756-36-2 4-tert-Butyl-3-chloroaniline