Home Bromides 1129-28-8
1129-28-8,MFCD00051437
Catalog No.:AA00353M

1129-28-8 | Methyl 3-(bromomethyl)benzoate

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Purity
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Price(USD)
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1g
98%
in stock  
$11.00   $8.00
- +
5g
98%
in stock  
$16.00   $11.00
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100g
98%
in stock  
$173.00   $121.00
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500g
98%
in stock  
$803.00   $562.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00353M
Chemical Name:
Methyl 3-(bromomethyl)benzoate
CAS Number:
1129-28-8
Molecular Formula:
C9H9BrO2
Molecular Weight:
229.0706
MDL Number:
MFCD00051437
SMILES:
COC(=O)c1cccc(c1)CBr
Properties
Properties
 
BP:
112-114°C at 760 mmHg  
Form:
Solid  
MP:
41-45 °C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
159  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
3  

Upstream Synthesis Route

[1]OrganicandBiomolecularChemistry,2003,vol.1,#14,p.2506-2511

[2]Patent:CN106146413,2016,A,.Locationinpatent:Paragraph0027;0028

[3]EuropeanJournalofMedicinalChemistry,2009,vol.44,#1,p.7-17

[4]Molecules,2016,vol.21,#12,

[5]Patent:WO2018/169777,2018,A1,.Locationinpatent:Paragraph0227

[6]Patent:US2008/51397,2008,A1,.Locationinpatent:Page/Pagecolumn9;21-22

[7]Patent:WO2011/47156,2011,A1,.Locationinpatent:Page/Pagecolumn89

[8]JournalofOrganicChemistry,2002,vol.67,#7,p.2160-2167

[9]JournalofOrganicChemistry,2017,vol.82,#2,p.1114-1126

[10]Farmaco,EdizioneScientifica,1987,vol.42,#6,p.409-424

[11]OrganicLetters,2013,vol.15,#4,p.917-919

[12]JournaloftheAmericanChemicalSociety,2010,vol.132,#49,p.17366-17369

[13]Chemistry-AEuropeanJournal,2016,vol.22,#49,p.17576-17580

[14]RSCAdvances,2013,vol.3,#45,p.23119-23127

[15]CollectionofCzechoslovakChemicalCommunications,2004,vol.69,#12,p.2239-2252

[16]Organometallics,2015,vol.34,#9,p.1627-1634

[17]Patent:US2010/210593,2010,A1,.Locationinpatent:Page/Pagecolumn46

[18]Patent:EP2942346,2015,A1,.Locationinpatent:Paragraph0158

[19]JournalofOrganicChemistry,1959,vol.24,p.1952,1954

[20]JournalofMedicinalChemistry,1987,vol.30,#1,p.96-104

[21]JournalofOrganicChemistry,1992,vol.57,#3,p.965-969

[22]ChemicalandPharmaceuticalBulletin,1997,vol.45,#2,p.297-304

[23]JournalofMedicinalChemistry,2002,vol.45,#18,p.3891-3904

[24]JournalofMedicinalChemistry,2003,vol.46,#3,p.345-348

[25]JournalofMedicinalChemistry,2000,vol.43,#24,p.4667-4677

[26]Patent:WO2004/43966,2004,A1,.Locationinpatent:Page49

[27]BioorganicandMedicinalChemistryLetters,2008,vol.18,#10,p.3122-3125

[28]Patent:EP1577302,2005,A1,.Locationinpatent:Page/Pagecolumn116-117

[29]JournalofMedicinalChemistry,2009,vol.52,#10,p.3317-3327

[30]AngewandteChemie-InternationalEdition,2010,vol.49,#37,p.6633-6637

[31]Chemistry-AEuropeanJournal,2012,vol.18,#5,p.1383-1400

[32]Chemistry-AEuropeanJournal,2015,vol.21,#28,p.10179-10184

[33]EuropeanJournalofInorganicChemistry,2017,vol.2017,#13,p.1845-1854

[1]Patent:WO2011/20615,2011,A1,.Locationinpatent:Page/Pagecolumn45;47

[2]Patent:EP2289883,2011,A1,.Locationinpatent:Page/Pagecolumn18

[3]JournalofMedicinalChemistry,2007,vol.50,#7,p.1711-1715

[4]Patent:EP1445249,2004,A1,.Locationinpatent:Page136

[5]BioorganicandMedicinalChemistryLetters,2014,vol.24,#2,p.476-479

[6]Patent:WO2014/121931,2014,A1,.Locationinpatent:Page/Pagecolumn26

[1]Patent:WO2008/35379,2008,A2,.Locationinpatent:Page/Pagecolumn11

[1]Patent:EP1550662,2005,A1,.Locationinpatent:Page/Pagecolumn20

[2]Organicandbiomolecularchemistry,2004,vol.2,#12,p.1732-1741

[1]Patent:WO2011/21209,2011,A1,.Locationinpatent:Page/Pagecolumn57;58

[2]Patent:US2012/101099,2012,A1,.Locationinpatent:Page/Pagecolumn22;23

Downstream Synthesis Route

[1]Okada,Yukihiro;Yokozawa,Masanori;Akiba,Miwa;Oishi,Kazuhiko;O-Kawa,Kyoji;Akeboshi,Tomohiro;Kawamura,Yasuo;Inokuma,Seiichi;Nakamura,Yosuke;Nishimura,Jun[OrganicandBiomolecularChemistry,2003,vol.1,#14,p.2506-2511]

[2]CurrentPatentAssignee:CENTRALSOUTHUNIVERSITY-CN106146413,2016,ALocationinpatent:Paragraph0027;0028

[3]Locationinpatent:experimentalpartSheng,Rong;Xu,Yu;Hu,Chunqi;Zhang,Jing;Lin,Xiao;Li,Jingya;Yang,Bo;He,Qiaojun;Hu,Yongzhou[EuropeanJournalofMedicinalChemistry,2009,vol.44,#1,p.7-17]

[4]He,Haibing;Ge,Yinghua;Dai,Hong;Cui,Song;Ye,Fei;Jin,Jia;Shi,Yujun[Molecules,2016,vol.21,#12]

[5]CurrentPatentAssignee:BIOTHERYXINC-WO2018/169777,2018,A1Locationinpatent:Paragraph0227

[6]CurrentPatentAssignee:CENTRALSOUTHUNIVERSITY-CN111747883,2020,ALocationinpatent:Paragraph0017-0018;0021-0022

[7]CurrentPatentAssignee:MERCKKGAA-US2008/51397,2008,A1Locationinpatent:Page/Pagecolumn9;21-22

[8]CurrentPatentAssignee:UMASSMEMORIALHEALTHCAREINC-WO2011/47156,2011,A1Locationinpatent:Page/Pagecolumn89

[9]Dvornikovs,Vadims;Smithrud,DavidB.[JournalofOrganicChemistry,2002,vol.67,#7,p.2160-2167]

[10]CurrentPatentAssignee:ZHEJIANGUNIVERSITY-CN110128299,2019,ALocationinpatent:Paragraph0035;0039-0041

[11]Das,Riki;Kapur,Manmohan[JournalofOrganicChemistry,2017,vol.82,#2,p.1114-1126]

[12]DeAmici;DeMicheli;Pratesi;Grana;SantagostinoBarbone;Cappello;Silipo;Vittoria[Farmaco,EdizioneScientifica,1987,vol.42,#6,p.409-424]

[13]Levin,VitalijV.;Zemtsov,ArtemA.;Struchkova,MarinaI.;Dilman,AlexanderD.[OrganicLetters,2013,vol.15,#4,p.917-919]

[14]Cao,Rui;Mueller,Peter;Lippard,StephenJ.[JournaloftheAmericanChemicalSociety,2010,vol.132,#49,p.17366-17369]

[15]Zhang,Zongyao;Zheng,Kunyi;Xia,Tianlong;Xu,Lijin;Cao,Rui[Chemistry-AEuropeanJournal,2016,vol.22,#49,p.17576-17580]

[16]Dobrzynska,Danuta;Kubiak,Joanna;Janczak,Jan;Zon,Jerzy[RSCAdvances,2013,vol.3,#45,p.23119-23127]

[17]Picha,Jan;Cibulka,Radek;Liska,Frantisek;Parik,Patrik;Pytela,Oldrich[CollectionofCzechoslovakChemicalCommunications,2004,vol.69,#12,p.2239-2252]

[18]Fleckhaus,André;Mousa,AbdelrazekH.;Lawal,NasirSallau;Kazemifar,NitsaKiriakidou;Wendt,OlaF.[Organometallics,2015,vol.34,#9,p.1627-1634]

[19]CurrentPatentAssignee:SYNTRIXBIOSYSTEMS-US2010/210593,2010,A1Locationinpatent:Page/Pagecolumn46

[20]CurrentPatentAssignee:SYNTRIXBIOSYSTEMS-EP2942346,2015,A1Locationinpatent:Paragraph0158

[21]Turner;Gearien[JournalofOrganicChemistry,1959,vol.24,p.1952,1954]

[22]Musser;Chakraborty;Sciortino;Gordon;Khandwala;Neiss;Pruss;VanInwegen;Weinryb;Coutts[JournalofMedicinalChemistry,1987,vol.30,#1,p.96-104]

[23]Holoboski;Koft[JournalofOrganicChemistry,1992,vol.57,#3,p.965-969]

[24]Kotani,Takayuki;Ishii,Akira;Nagaki,Yasuhiro;Toyomaki,Yoshio;Yago,Hisashi;Suehiro,Seishi;Okukado,Nobuhisa;Okamoto,Kaoru[ChemicalandPharmaceuticalBulletin,1997,vol.45,#2,p.297-304]

[25]Durley,RichardC.;Grapperhaus,MargaretL.;Hickory,BrianS.;Massa,MarkA.;Wang,JaneL.;Spangler,DaleP.;Mischke,DeborahA.;Parnas,BarryL.;Fobian,YvetteM.;Rath,NigamP.;Honda,DorothyD.;Zeng,Ming;Connolly,DanielT.;Heuvelman,DeborahM.;Witherbee,BryanJ.;Melton,MicheleA.;Glenn,KevinC.;Krul,ElaineS.;Smith,MarkE.;Sikorski,JamesA.[JournalofMedicinalChemistry,2002,vol.45,#18,p.3891-3904]

[26]Colarusso,Stefania;Koch,Uwe;Gerlach,Benjamin;Steinkühler,Christian;DeFrancesco,Raffaele;Altamura,Sergio;Matassa,VictorG.;Narjes,Frank[JournalofMedicinalChemistry,2003,vol.46,#3,p.345-348]

[27]Shinkai;Ito;Iida;Kitao;Yamada;Uchida[JournalofMedicinalChemistry,2000,vol.43,#24,p.4667-4677]

[28]CurrentPatentAssignee:ALMIRALLSA-WO2004/43966,2004,A1Locationinpatent:Page49

[29]Clift,MichaelD.;Silverman,RichardB.[BioorganicandMedicinalChemistryLetters,2008,vol.18,#10,p.3122-3125]

[30]CurrentPatentAssignee:DAIICHISANKYOCOMPANY,LIMITED-EP1577302,2005,A1Locationinpatent:Page/Pagecolumn116-117

[31]Locationinpatent:bodytextWydysh,EdwardA.;Medghalchi,SusanM.;Vadlamudi,Aravinda;Townsendd,CraigA.[JournalofMedicinalChemistry,2009,vol.52,#10,p.3317-3327]

[32]Pignataro,Luca;Carboni,Stefano;Civera,Monica;Colombo,Raffaele;Piarulli,Umberto;Gennari,Cesare[AngewandteChemie-InternationalEdition,2010,vol.49,#37,p.6633-6637]

[33]Pignataro,Luca;Boghi,Michele;Civera,Monica;Carboni,Stefano;Piarulli,Umberto;Gennari,Cesare[Chemistry-AEuropeanJournal,2012,vol.18,#5,p.1383-1400]

[34]Behera,Harekrushna;Ramkumar,Venkatachalam;Madhavan,Nandita[Chemistry-AEuropeanJournal,2015,vol.21,#28,p.10179-10184]

[35]Sun,Ying-Ji;Li,Pei;Huang,Qian-Qian;Zhang,Jian-Jun;Itoh,Shinobu[EuropeanJournalofInorganicChemistry,2017,vol.2017,#13,p.1845-1854]

[36]Schierle,Simone;Helmstädter,Moritz;Schmidt,Jurema;Hartmann,Markus;Horz,Maximiliane;Kaiser,Astrid;Weizel,Lilia;Heitel,Pascal;Proschak,Anna;Hernandez-Olmos,Victor;Proschak,Ewgenij;Merk,Daniel[ChemMedChem,2020,vol.15,#1,p.50-67]

[37]Wu,Han;Sun,Yu;Wong,WeeLin;Cui,Jiajia;Li,Jingyang;You,Xuefu;Yap,LeeFah;Huang,Yu;Hong,Wei;Yang,Xinyi;Paterson,IanC.;Wang,Hao[EuropeanJournalofMedicinalChemistry,2020,vol.189]

[38]Tang,Xuehang;Ning,Mengmeng;Ye,Yangliang;Gu,Yipei;Yan,Hongyi;Leng,Ying;Shen,Jianhua[BioorganicandMedicinalChemistry,2021,vol.43]

[39]Ge,Shaozhong;Yang,Xiaoxu[Organometallics,2022]

[1]MagneticResonanceinChemistry,1989,vol.27,p.585-591

40786-69-4    1129-28-8   
3-(4-Acetyl-3-hydroxy-2-propylphenoxy)methylbenzoicacidmethylester 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US4672066,1987,A

[2]Brown;Bersntein;Cronk;Dossett;Hebbel;MaduskuieJr.;Shapiro;Vacek;Yee;Willard;Krell;Snyder[JournalofMedicinalChemistry,1989,vol.32,#4,p.807-826]

[1]JournalofOrganicChemistry,1993,vol.58,p.6372-6376

[1]JournalofMedicinalChemistry,1995,vol.38,p.3772-3779

Literature

Title: Methyl 2-[(2-methyl-phen-oxy)meth-yl]benzoate.

Journal: Acta crystallographica. Section E, Structure reports online 20120301

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Tags:1129-28-8 Molecular Formula|1129-28-8 MDL|1129-28-8 SMILES|1129-28-8 Methyl 3-(bromomethyl)benzoate |Organic_Building_Blocks