Name: Name:2-(2-Bromophenyl)propanoic acid
Brand: AABLOCKS
SKU: AA00ANUO
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00ANUO

Chemical Name: 2-(2-Bromophenyl)propanoic acid

CAS Number: 153184-13-5

Molecular Formula: C9H9BrO2

Molecular Weight: 229.0706

MDL Number: MFCD11041474

SMILES: OC(=O)C(c1ccccc1Br)C

Properties

Complexity: 170

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 12

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 1

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 1

Undefined Bond Stereocenter Count: 0

XLogP3: 2.6

Downstream Synthesis Route

18698-97-0

74-88-4

153184-13-5

[1]Dochnahl,Maximilian;Fu,GregoryC.[AngewandteChemie-InternationalEdition,2009,vol.48,p.2391-2393][Angew.Chem.,Int.Ed.,2009,vol.121,p.2427-2429]

[2]Beak,Peter;Kerrick,ShawnT.;Gallagher,DonaldJ.[JournaloftheAmericanChemicalSociety,1993,vol.115,#23,p.10628-10636]

[3]Locationinpatent:schemeortableVolpe,EmilyC.;Manke,DavidR.;Bartholomew,ErikaR.;Wolczanski,PeterT.;Lobkovsky,EmilB.[Organometallics,2010,vol.29,#24,p.6642-6652]

[4]Dong,Xiao-Yang;Du,Xuan-Yi;Fang,Jia-Heng;Gu,Qiang-Shuai;Li,Zhong-Liang;Liu,Xin-Yuan;Wang,Li-Lei;Xia,Hai-Dong[AngewandteChemie-InternationalEdition,2020,vol.59,#39,p.16926-16932][Angew.Chem.,2020,vol.132,#39,p.17074-17080,7]

18698-97-0

153184-13-5

[1]Gualtieri;Conti;Dei;Giovannoni;Nannucci;Romanelli;Scapecchi;Teodori;Fanfani;Ghelardini;Giotti;Bartolini[JournalofMedicinalChemistry,1994,vol.37,#11,p.1704-1711]

[2]CurrentPatentAssignee:SANOFI-US5902803,1999,A

[3]Kukosha,Tatyana;Trufilkina,Nadezhda;Katkevics,Martins[Synlett,2011,#17,p.2525-2528]

153184-13-5

74-88-4

113948-00-8

[1]Locationinpatent:schemeortableVolpe,EmilyC.;Manke,DavidR.;Bartholomew,ErikaR.;Wolczanski,PeterT.;Lobkovsky,EmilB.[Organometallics,2010,vol.29,#24,p.6642-6652]

153184-13-5 | 2-(2-Bromophenyl)propanoic acid