Name: Name:2-(Bromomethyl)-1-chloro-4-nitrobenzene
Brand: AABLOCKS
SKU: AA00DALW
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00DALW

Chemical Name: 2-(Bromomethyl)-1-chloro-4-nitrobenzene

CAS Number: 52427-01-7

Molecular Formula: C7H5BrClNO2

Molecular Weight: 250.4771

MDL Number: MFCD01221044

SMILES: BrCc1cc(ccc1Cl)[N+](=O)[O-]

Properties

BP: 329°C at 760 mmHg

Storage: Keep in dry area;2-8℃;

Complexity: 173

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: 0

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.9

Downstream Synthesis Route

13290-74-9

52427-01-7

[1]JournalofMedicinalChemistry,2009,vol.52,p.1828-1844

[2]Patent:WO2008/117175,2008,A2.Locationinpatent:Page/Pagecolumn150-151

[3]JournalofOrganicChemistryUSSR(EnglishTranslation),1974,vol.10,p.92-95 ZhurnalOrganicheskoiKhimii,1974,vol.10,p.92-95

109-00-2

52427-01-7

642084-74-0

[1]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73891,2016,A1Locationinpatent:Paragraph00228

[2]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73895,2016,A1Locationinpatent:Paragraph00296

[3]Gill,AdrianL.;Frederickson,Martyn;Cleasby,Anne;Woodhead,StevenJ.;Carr,MariaG.;Woodhead,AndrewJ.;Walker,MargaretT.;Congreve,MilesS.;Devine,LindsayA.;Tisi,Dominic;O'Reilly,Marc;Seavers,LisaC.A.;Davis,DeborahJ.;Curry,Jayne;Anthony,Eachel;Padova,Alessandro;Murray,ChristopherW.;Carr,RobinA.E.;Jhoti,Harren[JournalofMedicinalChemistry,2005,vol.48,#2,p.414-426]

[4]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2004/4720,2004,A1Locationinpatent:Page/Pagecolumn68

[5]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73889,2016,A1Locationinpatent:Paragraph00253

80866-80-4

52427-01-7

[1]Gill,AdrianL.;Frederickson,Martyn;Cleasby,Anne;Woodhead,StevenJ.;Carr,MariaG.;Woodhead,AndrewJ.;Walker,MargaretT.;Congreve,MilesS.;Devine,LindsayA.;Tisi,Dominic;O'Reilly,Marc;Seavers,LisaC.A.;Davis,DeborahJ.;Curry,Jayne;Anthony,Eachel;Padova,Alessandro;Murray,ChristopherW.;Carr,RobinA.E.;Jhoti,Harren[JournalofMedicinalChemistry,2005,vol.48,#2,p.414-426]

[2]CurrentPatentAssignee:POLARISPHARMACEUTICALS-US2017/369489,2017,A1Locationinpatent:Paragraph0264;0265

[3]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73891,2016,A1Locationinpatent:Paragraph00227

[4]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73895,2016,A1Locationinpatent:Paragraph00295

[5]Palmer,BrianD.;Thompson,AndrewM.;Booth,R.John;Dobrusin,EllenM.;Kraker,AlanJ.;Lee,HoH.;Lunney,ElizabethA.;Mitchell,LornaH.;Ortwine,DanielF.;Smaill,JeffB.;Swan,LeesaM.;Denny,WilliamA.[JournalofMedicinalChemistry,2006,vol.49,#16,p.4896-4911]

[6]CurrentPatentAssignee:OTSUKAHOLDINGSCOLTD-WO2004/4720,2004,A1Locationinpatent:Page/Pagecolumn67

[7]CurrentPatentAssignee:BIALRDINVESTMENTS-WO2016/73889,2016,A1Locationinpatent:Paragraph00252

52427-01-7

55758-32-2

5-(2-chloro-5-nitro-benzyloxy)-2-fluoro-pyridine

[1]Patent:WO2004/4720,2004,A1.Locationinpatent:Page/Pagecolumn69-70

52427-01-7 | 2-(Bromomethyl)-1-chloro-4-nitrobenzene