Home Bromides 147962-81-0
147962-81-0,MFCD11042852
Catalog No.:AA001F99

147962-81-0 | Ethyl 3-bromo-4-methylbenzoate

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1g
99%
in stock  
$39.00   $27.00
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5g
98%
in stock  
$52.00   $36.00
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25g
98%
in stock  
$96.00   $68.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001F99
Chemical Name:
Ethyl 3-bromo-4-methylbenzoate
CAS Number:
147962-81-0
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD11042852
SMILES:
CCOC(=O)c1ccc(c(c1)Br)C
Properties
Computed Properties
 
Complexity:
182  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
3.2  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1993,vol.115,p.3199-3211

[1]Locationinpatent:experimentalpartKubota,Katsumi;Kurebayashi,Hirotaka;Miyachi,Hirotaka;Tobe,Masanori;Onishi,Masako;Isobe,Yoshiaki[BioorganicandMedicinalChemistry,2011,vol.19,#9,p.3005-3021]

[2]Gilbert,AdamM.;Katz,ThomasJ.;Geiger,WilliamE.;Robben,MatthewP.;Rheingold,ArnoldL.[JournaloftheAmericanChemicalSociety,1993,vol.115,#8,p.3199-3211]

[3]Asaki,Tetsuo;Sugiyama,Yukiteru;Hamamoto,Taisuke;Higashioka,Masaya;Umehara,Masato;Naito,Haruna;Niwa,Tomoko[BioorganicandMedicinalChemistryLetters,2006,vol.16,#5,p.1421-1425]

[4]Kasibhatla,SrinivasRao;Bookser,BrettC.;Probst,Gary;Appleman,JamesR.;Erion,MarkD.[JournalofMedicinalChemistry,2000,vol.43,#8,p.1508-1518]

[5]Zhang,Rui;Lei,Lin;Xu,Yun-Gen;Hua,Wei-Yi;Gong,Guo-Qing[BioorganicandMedicinalChemistryLetters,2007,vol.17,#9,p.2430-2433]

[6]CurrentPatentAssignee:NIPPONSHINYAKUCOLTD-EP1533304,2005,A1Locationinpatent:Page/Pagecolumn13

[7]Locationinpatent:schemeortableXu,Wen-Ting;Jin,Ning;Xu,Jing;Xu,Yun-Gen;Wang,Qiu-Juan;You,Qi-Dong[BioorganicandMedicinalChemistryLetters,2009,vol.19,#12,p.3283-3287]

[8]Sedgwick,AdamC.;Chapman,RobertS.L.;Gardiner,JordanE.;Peacock,LucyR.;Kim,Gyoungmi;Yoon,Juyoung;Bull,StevenD.;James,TonyD.[ChemicalCommunications,2017,vol.53,#75,p.10441-10443]

[1]Kasibhatla,SrinivasRao;Bookser,BrettC.;Probst,Gary;Appleman,JamesR.;Erion,MarkD.[JournalofMedicinalChemistry,2000,vol.43,#8,p.1508-1518]

[1]Patent:CN110078708,2019,A.Locationinpatent:Paragraph0044;0045;0048-0051

[2]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.1421-1425

[3]ChineseChemicalLetters,2011,vol.22,p.1215-1218

[4]ChemicalCommunications,2017,vol.53,p.10441-10443

905712-53-0    147962-81-0   
C22H22O4 

[1]Elliott,ErinL.;Ray,ChristianR.;Kraft,Stefan;Atkins,JosephR.;Moore,JeffreyS.[JournalofOrganicChemistry,2006,vol.71,#14,p.5282-5290]

Literature
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