Name: Name:3-(3-Bromophenyl)-3-oxo-propionic acid methyl ester
Brand: AABLOCKS
SKU: AA002YGV
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA002YGV

Chemical Name: 3-(3-Bromophenyl)-3-oxo-propionic acid methyl ester

CAS Number: 294881-10-0

Molecular Formula: C10H9BrO3

Molecular Weight: 257.0807

MDL Number: MFCD03424774

SMILES: COC(=O)CC(=O)c1cccc(c1)Br

Properties

Storage: 2-8℃;

Complexity: 227

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 14

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 4

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.3

Downstream Synthesis Route

53250-82-1

294881-10-0

3-(3-bromo-phenyl)-<i>N</i>-(4-methanesulfonylamino-phenyl)-3-oxo-propionamide

[1]BioorganicandMedicinalChemistryLetters,2003,vol.13,p.2985-2988

2142-63-4

616-38-6

294881-10-0

[1]Balamurugan,Rengarajan;Manojveer,Seetharaman[ChemicalCommunications,2011,vol.47,#39,p.11143-11145]

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2004/76414,2004,A2Locationinpatent:Page15-16

[3]Borowiecki,Pawel;Bretner,Maria[TetrahedronAsymmetry,2013,vol.24,#15-16,p.925-936]

[4]Tang,Jun;Shewchuk,LisaM.;Sato,Hideyuki;Hasegawa,Masaichi;Washio,Yoshiaki;Nishigaki,Naohiko[BioorganicandMedicinalChemistryLetters,2003,vol.13,#18,p.2985-2988]

[5]Chen,Gen-Qiang;Tang,Xiang-Ying;Shi,Min[ChemicalCommunications,2012,vol.48,#17,p.2340-2342]

[6]Chong,Siying;Su,Yingpeng;Wu,Lili;Zhang,Weigang;Ma,Junyan;Chen,Xiaowei;Huang,Danfeng;Wang,Ke-Hu;Hu,Yulai[Synthesis,2016,vol.48,#9,p.1359-1370]

[7]Zhang,Yong;Zhao,Xiaoyuan;Zhuang,Chen;Wang,Senlin;Zhang-Negrerie,Daisy;Du,Yunfei[AdvancedSynthesisandCatalysis,2018,vol.360,#11,p.2107-2112]

[8]Sun,Jiyun;Zhen,Xiaohua;Ge,Huaibin;Zhang,Guangtao;An,Xuechan;Du,Yunfei[BeilsteinJournalofOrganicChemistry,2018,vol.14,p.1452-1458]

[9]Liu,Hao-Nan;Cao,Hao-Qiang;Cheung,ChiWai;Ma,Jun-An[OrganicLetters,2020,vol.22,#4,p.1396-1401]

[10]Wang,Zheng-Hai;Wang,Dong-Hui[OrganicLetters,2022,vol.24,#2,p.782-785]

294881-10-0 | 3-(3-Bromophenyl)-3-oxo-propionic acid methyl ester