40155-54-2,MFCD03411525
Catalog No.:AA00CLED

40155-54-2 | Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
97%
2 weeks  
$136.00   $95.00
- +
1g
97%
2 weeks  
$208.00   $146.00
- +
5g
97%
2 weeks  
$595.00   $417.00
- +
50g
95+%
2 weeks  
$4,623.00   $3,236.00
- +
100g
95+%
2 weeks  
$6,552.00   $4,586.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00CLED
Chemical Name:
Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate
CAS Number:
40155-54-2
Molecular Formula:
C12H11BrO4
Molecular Weight:
299.1173
MDL Number:
MFCD03411525
SMILES:
CCOC(=O)C(=O)CC(=O)c1ccc(cc1)Br
Properties
Computed Properties
 
Complexity:
306  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63

[2]Gao,Yaojun;Samanta,Sanjay;Cui,Taian;Lam,Yulin[ChemMedChem,2013,vol.8,#9,p.1554-1560]

[3]Riahi,Abdolmajid;Shkoor,Mohanad;Fatunsin,Olumide;Khera,RasheedAhmad;Fischer,Christine;Langer,Peter[OrganicandBiomolecularChemistry,2009,vol.7,#20,p.4248-4251]

[4]Locationinpatent:experimentalpartGeffken,Detlef;Soliman,Raafat;Soliman,FaridS.D.;Abdel-Khalek,MagdiM.;Issa,DoaaA.E.[MedicinalChemistryResearch,2011,vol.20,#4,p.408-420]

[5]CurrentPatentAssignee:ELLORATHERAPEUTICS-WO2015/35015,2015,A1Locationinpatent:Page/Pagecolumn65

[6]CurrentPatentAssignee:RALEXARTHERAPEUTICS-WO2015/35027,2015,A1Locationinpatent:Paragraph114

[7]Roy,AmrendraK.;Batra,Sanjay[Synthesis,2003,#15,p.2325-2330]

[8]Locationinpatent:schemeortablePalin,Ronald;Abernethy,Lynn;Ansari,Nasrin;Cameron,Kenneth;Clarkson,Tom;Dempster,Maureen;Dunn,David;Easson,Anna-Marie;Edwards,Darren;MacLean,John;Everett,Katy;Feilden,Helen;Ho,Koc-Kan;Kultgen,Steve;Littlewood,Peter;McArthur,Duncan;McGregor,Deborah;McLuskey,Hazel;Neagu,Irina;Neale,Stuart;Nisbet,Lesley-Anne;Ohlmeyer,Michael;Pham,Quynhchi;Ratcliffe,Paul;Rong,Yajing;Roughton,Andrew;Sammons,Melanie;Swanson,Robert;Tracey,Heather;Walker,Glenn[BioorganicandMedicinalChemistryLetters,2011,vol.21,#3,p.892-898]

[9]Locationinpatent:experimentalpartWang,Yi;Xu,Weiren;Shao,Hua;Xie,Yafei;Wang,Jianwu[ChineseJournalofChemistry,2011,vol.29,#10,p.2039-2048]

[10]Tian,Wei;Han,Guangqian;Zhu,Ju;Qi,Jingjing;Chen,Qianqian;Zhao,Juntao;Zheng,Canhui;Zhang,Ling;Zhou,Youjun;Lv,Jiaguo[BioorganicandMedicinalChemistryLetters,2013,vol.23,#14,p.4177-4184]

[11]Goli-Garmroodi,Fereshteh;Omidi,Marzieh;Saeedi,Mina;Sarrafzadeh,Farhad;Rafinejad,Ali;Mahdavi,Mohammad;Bardajee,GhasemRezanejade;Akbarzadeh,Tahmineh;Firoozpour,Loghman;Shafiee,Abbas;Foroumadi,Alireza[TetrahedronLetters,2015,vol.56,#5,p.743-746]

[12]Ghaedi;Bardajee;Mirshokrayi;Mahdavi;Shafiee;Akbarzadeh[RSCAdvances,2015,vol.5,#109,p.89652-89658]

[13]Zagni,Chiara;Rescifina,Antonio;Citarella,Andrea;Maugeri,Alessandro;Navarra,Michele;Scala,Angela;Piperno,Anna;Micale,Nicola;Oussama,Mahjoub[InternationalJournalofMolecularSciences,2019,vol.20,#4]

[14]HafezTaghva,Pardis;Kabirifard,Hassan[JournalofSulfurChemistry,2020,vol.41,#2,p.200-209]

[15]Akbarzadeh,Tahmineh;Edraki,Najmeh;Firuzi,Omidreza;Hariri,Roshanak;Mahdavi,Mohammad;Mirfazli,SeyedehSara;Rastegari,Arezoo;Saeedi,Mina[Chemistryandbiodiversity,2020]

[16]Ghaedi,Aseyeh;Bardajee,GhasemRezanejade;Delbari,AkramSadat;Hekmat,Shohreh[Arkivoc,2020,vol.2020,#6]

[17]CurrentPatentAssignee:BASFSE-WO2020/83733,2020,A1Locationinpatent:Page/Pagecolumn148

[18]Selvendran,Suresh;Rajendran,Saravanakumar[SyntheticCommunications,2021,vol.51,#3,p.437-445]

[19]Saeedi,Mina;Felegari,Peyman;Iraji,Aida;Hariri,Roshanak;Rastegari,Arezoo;Mirfazli,S.Sara;Edraki,Najmeh;Firuzi,Omidreza;Mahdavi,Mohammad;Akbarzadeh,Tahmineh[ArchivderPharmazie,2021,vol.354,#3]

[20]Jiang,Jia;Hou,Yunlei;Duan,Meibo;Wang,Baihang;Wu,Yachuang;Ding,Xiudong;Zhao,Yanfang[BioorganicandMedicinalChemistryLetters,2021,vol.32]

[21]Saeedi,Mina;Eslami,Azadeh;Mirfazli,SeyedehSara;Zardkanlou,Mahsa;Faramarzi,MohammadAli;Mahdavi,Mohammad;Akbarzadeh,Tahmineh[Lettersindrugdesignanddiscovery,2021,vol.18,#5,p.436-444]

[22]Adib,Mehdi;Azizian,Homa;Biglar,Mahmood;Faramarzi,MohammadAli;Gashghaee,Mojtaba;Larijani,Bagher;Mahdavi,Mohammad;Mohammadi-Khanaposhtani,Maryam;Mojtabavi,Somayeh;Rastegar,Hossein;Rezaei,Yahya[JournalofMolecularStructure,2022,vol.1257]

[1]Roy,AmrendraK.;Batra,Sanjay[Synthesis,2003,#15,p.2325-2330]

[2]Akbarzadeh,Tahmineh;Rafinejad,Ali;Mollaghasem,JavadMalekian;Safavi,Maliheh;Fallah-Tafti,Asal;Pordeli,Mahboobeh;Ardestani,SussanKabudanian;Shafiee,Abbas;Foroumadi,Alireza[ArchivderPharmazie,2012,vol.345,#5,p.386-392]

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63-64

[1]Locationinpatent:experimentalpartWang,Yi;Xu,Weiren;Shao,Hua;Xie,Yafei;Wang,Jianwu[ChineseJournalofChemistry,2011,vol.29,#10,p.2039-2048]

[2]Zagni,Chiara;Rescifina,Antonio;Citarella,Andrea;Maugeri,Alessandro;Navarra,Michele;Scala,Angela;Piperno,Anna;Micale,Nicola;Oussama,Mahjoub[InternationalJournalofMolecularSciences,2019,vol.20,#4]

[3]Jiang,Jia;Hou,Yunlei;Duan,Meibo;Wang,Baihang;Wu,Yachuang;Ding,Xiudong;Zhao,Yanfang[BioorganicandMedicinalChemistryLetters,2021,vol.32]

[1]Chemistry-AEuropeanJournal,2012,vol.18,p.6520-6527

Literature
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SDS
Tags:40155-54-2 Molecular Formula|40155-54-2 MDL|40155-54-2 SMILES|40155-54-2 Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate
Catalog No.: AA00CLED
40155-54-2,MFCD03411525
40155-54-2 | Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate
Pack Size: 500mg
Purity: 97%
2 weeks
$136.00 $95.00
Pack Size: 1g
Purity: 97%
2 weeks
$208.00 $146.00
Pack Size: 5g
Purity: 97%
2 weeks
$595.00 $417.00
Pack Size: 50g
Purity: 95+%
2 weeks
$4,623.00 $3,236.00
Pack Size: 100g
Purity: 95+%
2 weeks
$6,552.00 $4,586.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00CLED
Chemical Name: Ethyl 4-(4-bromophenyl)-2,4-dioxobutanoate
CAS Number: 40155-54-2
Molecular Formula: C12H11BrO4
Molecular Weight: 299.1173
MDL Number: MFCD03411525
SMILES: CCOC(=O)C(=O)CC(=O)c1ccc(cc1)Br
Properties
Complexity: 306  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Downstream Synthesis Route
99-90-1    95-92-1    40155-54-2 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63

[2]Gao,Yaojun;Samanta,Sanjay;Cui,Taian;Lam,Yulin[ChemMedChem,2013,vol.8,#9,p.1554-1560]

[3]Riahi,Abdolmajid;Shkoor,Mohanad;Fatunsin,Olumide;Khera,RasheedAhmad;Fischer,Christine;Langer,Peter[OrganicandBiomolecularChemistry,2009,vol.7,#20,p.4248-4251]

[4]Locationinpatent:experimentalpartGeffken,Detlef;Soliman,Raafat;Soliman,FaridS.D.;Abdel-Khalek,MagdiM.;Issa,DoaaA.E.[MedicinalChemistryResearch,2011,vol.20,#4,p.408-420]

[5]CurrentPatentAssignee:ELLORATHERAPEUTICS-WO2015/35015,2015,A1Locationinpatent:Page/Pagecolumn65

[6]CurrentPatentAssignee:RALEXARTHERAPEUTICS-WO2015/35027,2015,A1Locationinpatent:Paragraph114

[7]Roy,AmrendraK.;Batra,Sanjay[Synthesis,2003,#15,p.2325-2330]

[8]Locationinpatent:schemeortablePalin,Ronald;Abernethy,Lynn;Ansari,Nasrin;Cameron,Kenneth;Clarkson,Tom;Dempster,Maureen;Dunn,David;Easson,Anna-Marie;Edwards,Darren;MacLean,John;Everett,Katy;Feilden,Helen;Ho,Koc-Kan;Kultgen,Steve;Littlewood,Peter;McArthur,Duncan;McGregor,Deborah;McLuskey,Hazel;Neagu,Irina;Neale,Stuart;Nisbet,Lesley-Anne;Ohlmeyer,Michael;Pham,Quynhchi;Ratcliffe,Paul;Rong,Yajing;Roughton,Andrew;Sammons,Melanie;Swanson,Robert;Tracey,Heather;Walker,Glenn[BioorganicandMedicinalChemistryLetters,2011,vol.21,#3,p.892-898]

[9]Locationinpatent:experimentalpartWang,Yi;Xu,Weiren;Shao,Hua;Xie,Yafei;Wang,Jianwu[ChineseJournalofChemistry,2011,vol.29,#10,p.2039-2048]

[10]Tian,Wei;Han,Guangqian;Zhu,Ju;Qi,Jingjing;Chen,Qianqian;Zhao,Juntao;Zheng,Canhui;Zhang,Ling;Zhou,Youjun;Lv,Jiaguo[BioorganicandMedicinalChemistryLetters,2013,vol.23,#14,p.4177-4184]

[11]Goli-Garmroodi,Fereshteh;Omidi,Marzieh;Saeedi,Mina;Sarrafzadeh,Farhad;Rafinejad,Ali;Mahdavi,Mohammad;Bardajee,GhasemRezanejade;Akbarzadeh,Tahmineh;Firoozpour,Loghman;Shafiee,Abbas;Foroumadi,Alireza[TetrahedronLetters,2015,vol.56,#5,p.743-746]

[12]Ghaedi;Bardajee;Mirshokrayi;Mahdavi;Shafiee;Akbarzadeh[RSCAdvances,2015,vol.5,#109,p.89652-89658]

[13]Zagni,Chiara;Rescifina,Antonio;Citarella,Andrea;Maugeri,Alessandro;Navarra,Michele;Scala,Angela;Piperno,Anna;Micale,Nicola;Oussama,Mahjoub[InternationalJournalofMolecularSciences,2019,vol.20,#4]

[14]HafezTaghva,Pardis;Kabirifard,Hassan[JournalofSulfurChemistry,2020,vol.41,#2,p.200-209]

[15]Akbarzadeh,Tahmineh;Edraki,Najmeh;Firuzi,Omidreza;Hariri,Roshanak;Mahdavi,Mohammad;Mirfazli,SeyedehSara;Rastegari,Arezoo;Saeedi,Mina[Chemistryandbiodiversity,2020]

[16]Ghaedi,Aseyeh;Bardajee,GhasemRezanejade;Delbari,AkramSadat;Hekmat,Shohreh[Arkivoc,2020,vol.2020,#6]

[17]CurrentPatentAssignee:BASFSE-WO2020/83733,2020,A1Locationinpatent:Page/Pagecolumn148

[18]Selvendran,Suresh;Rajendran,Saravanakumar[SyntheticCommunications,2021,vol.51,#3,p.437-445]

[19]Saeedi,Mina;Felegari,Peyman;Iraji,Aida;Hariri,Roshanak;Rastegari,Arezoo;Mirfazli,S.Sara;Edraki,Najmeh;Firuzi,Omidreza;Mahdavi,Mohammad;Akbarzadeh,Tahmineh[ArchivderPharmazie,2021,vol.354,#3]

[20]Jiang,Jia;Hou,Yunlei;Duan,Meibo;Wang,Baihang;Wu,Yachuang;Ding,Xiudong;Zhao,Yanfang[BioorganicandMedicinalChemistryLetters,2021,vol.32]

[21]Saeedi,Mina;Eslami,Azadeh;Mirfazli,SeyedehSara;Zardkanlou,Mahsa;Faramarzi,MohammadAli;Mahdavi,Mohammad;Akbarzadeh,Tahmineh[Lettersindrugdesignanddiscovery,2021,vol.18,#5,p.436-444]

[22]Adib,Mehdi;Azizian,Homa;Biglar,Mahmood;Faramarzi,MohammadAli;Gashghaee,Mojtaba;Larijani,Bagher;Mahdavi,Mohammad;Mohammadi-Khanaposhtani,Maryam;Mojtabavi,Somayeh;Rastegar,Hossein;Rezaei,Yahya[JournalofMolecularStructure,2022,vol.1257]

40155-54-2    640292-04-2 

[1]Roy,AmrendraK.;Batra,Sanjay[Synthesis,2003,#15,p.2325-2330]

[2]Akbarzadeh,Tahmineh;Rafinejad,Ali;Mollaghasem,JavadMalekian;Safavi,Maliheh;Fallah-Tafti,Asal;Pordeli,Mahboobeh;Ardestani,SussanKabudanian;Shafiee,Abbas;Foroumadi,Alireza[ArchivderPharmazie,2012,vol.345,#5,p.386-392]

40155-54-2    60-34-4    618070-50-1    852815-31-7 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63-64

40155-54-2    1048930-76-2 

[1]Locationinpatent:experimentalpartWang,Yi;Xu,Weiren;Shao,Hua;Xie,Yafei;Wang,Jianwu[ChineseJournalofChemistry,2011,vol.29,#10,p.2039-2048]

[2]Zagni,Chiara;Rescifina,Antonio;Citarella,Andrea;Maugeri,Alessandro;Navarra,Michele;Scala,Angela;Piperno,Anna;Micale,Nicola;Oussama,Mahjoub[InternationalJournalofMolecularSciences,2019,vol.20,#4]

[3]Jiang,Jia;Hou,Yunlei;Duan,Meibo;Wang,Baihang;Wu,Yachuang;Ding,Xiudong;Zhao,Yanfang[BioorganicandMedicinalChemistryLetters,2021,vol.32]

73732-51-1    40155-54-2    198904-53-9    1395472-42-0 

[1]Chemistry-AEuropeanJournal,2012,vol.18,p.6520-6527

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