Name: Name:1-(4-Bromophenyl)-3,5-dimethylpyrazole
Brand: AABLOCKS
SKU: AA003CVM
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA003CVM

Chemical Name: 1-(4-Bromophenyl)-3,5-dimethylpyrazole

CAS Number: 62546-27-4

Molecular Formula: C11H11BrN2

Molecular Weight: 251.1224

MDL Number: MFCD09817558

SMILES: Brc1ccc(cc1)n1nc(cc1C)C

Properties

Form: Liquid

Storage: Keep in dry area;2-8℃;

Complexity: 190

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: 1

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 1

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 3.4

Downstream Synthesis Route

622-88-8

123-54-6

62546-27-4

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[3]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2009/119880,2009,A1Locationinpatent:Page/Pagecolumn149-150

[4]Şahin,Onur;Aktan,Ebru;CanbulatÖzdemir,Melek[JournalofMolecularStructure,2021,vol.1242]

123-54-6

589-21-9

62546-27-4

[1]Konwar,Manashjyoti;Elnagdy,HananMF;Gehlot,PraveenSingh;Khupse,NageshwarD;Kumar,Arvind;Sarma,Diganta[JournalofChemicalSciences,2019,vol.131,#8]

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[5]Hazarika,Roktopol;Konwar,Manashjyoti;Saikia,Munmi;Sarma,Diganta[TetrahedronLetters,2022]

[6]Katla,Ramesh;Chowrasia,Rakhi;Manjari,PadmaS.;DaSilva,CarenD.G.;DosSantos,BeatrizF.;Domingues,NelsonL.C.[NewJournalofChemistry,2016,vol.40,#11,p.9471-9476]

[7]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2021/48242,2021,A1Locationinpatent:Page/Pagecolumn52;67;68

[8]CurrentPatentAssignee:PHARMARONINC-WO2014/146491,2014,A1Locationinpatent:Page/Pagecolumn118

[9]Pan,Junyi;Liu,Cheng;Wang,Jianqiang;Dai,Yunqiao;Wang,Shengyu;Guo,Cheng[TetrahedronLetters,2021,vol.77]

66-27-3

62546-27-4

1-(4-bromophenyl)-2,3,5-trimethylpyrazoliummethanesulfonate

[1]JournalofMolecularLiquids,2017,vol.248,p.314-321

62546-27-4 | 1-(4-Bromophenyl)-3,5-dimethylpyrazole