Name: Name:5-Bromo-2-isopropoxybenzonitrile
Brand: AABLOCKS
SKU: AA00D8EM
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA00D8EM

Chemical Name: 5-Bromo-2-isopropoxybenzonitrile

CAS Number: 515832-52-7

Molecular Formula: C10H10BrNO

Molecular Weight: 240.0965

MDL Number: MFCD02257441

SMILES: N#Cc1cc(Br)ccc1OC(C)C

Properties

Complexity: 208

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 3.1

Downstream Synthesis Route

515832-52-7

73183-34-3

1258440-84-4

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2015/299179,2015,A1Locationinpatent:Paragraph0665;0666

[2]CurrentPatentAssignee:FUDANUNIVERSITY-EP3581561,2019,A1Locationinpatent:Paragraph0175-0176

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2010/148649,2010,A1Locationinpatent:Page/Pagecolumn78

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/113309,2011,A1Locationinpatent:Page/Pagecolumn24

[5]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2011/269738,2011,A1Locationinpatent:Page/Pagecolumn26

[6]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/134280,2011,A1Locationinpatent:Page/Pagecolumn51;52

[7]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2013/12491,2013,A1Locationinpatent:Paragraph0157;0158

75-30-9

40530-18-5

515832-52-7

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2010/148649,2010,A1Locationinpatent:Page/Pagecolumn77-78

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/113309,2011,A1Locationinpatent:Page/Pagecolumn24

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2011/269738,2011,A1Locationinpatent:Page/Pagecolumn26

[4]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/134280,2011,A1Locationinpatent:Page/Pagecolumn51

[5]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2013/12491,2013,A1Locationinpatent:Paragraph0155;0156

515832-52-7

1334608-11-5

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/113309,2011,A1

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2013/12491,2013,A1

515832-52-7

1334608-12-6

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/113309,2011,A1

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2013/12491,2013,A1

515832-52-7

1334608-13-7

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2011/113309,2011,A1

[2]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US2013/12491,2013,A1

515832-52-7 | 5-Bromo-2-isopropoxybenzonitrile