Home Boronic Acids 1135871-91-8
1135871-91-8,MFCD27936771
Catalog No.:AA0008YV

1135871-91-8 | 7-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-naphthalen-1-one

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100mg
98%
in stock  
$76.00   $54.00
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250mg
98%
in stock  
$123.00   $86.00
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1g
98%
in stock  
$323.00   $226.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0008YV
Chemical Name:
7-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-naphthalen-1-one
CAS Number:
1135871-91-8
Molecular Formula:
C16H21BO3
Molecular Weight:
272.1471
MDL Number:
MFCD27936771
SMILES:
O=C1CCCc2c1cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
389  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  

Downstream Synthesis Route

[1]Wang,Feng;Jeon,KyuOk;Salovich,JamesM.;Macdonald,JonathanD.;Alvarado,Joseph;Gogliotti,RoccoD.;Phan,Jason;Olejniczak,EdwardT.;Sun,Qi;Wang,Shidong;Camper,Demarco;Yuh,JoannesP.;Shaw,J.Grace;Sai,Jiqing;Rossanese,OliviaW.;Tansey,WilliamP.;Stauffer,ShaunR.;Fesik,StephenW.[JournalofMedicinalChemistry,2018,vol.61,#13,p.5623-5642]

[2]Nguyen,William;Lee,ErinnaF.;Evangelista,Marco;Lee,Mihwa;Harris,TiffanyJ.;Colman,PeterM.;Smith,NicholasA.;Williams,LukeB.;Jarman,KateE.;Lowes,KymN.;Haeberli,Cécile;Keiser,Jennifer;Smith,BrianJ.;Fairlie,W.Douglas;Sleebs,BradE.[ACSInfectiousDiseases,2021,vol.7,#5,p.1143-1163]

[3]Sleebs,BradE.;Kersten,WilhemusJ.A.;Kulasegaram,Sanji;Nikolakopoulos,George;Hatzis,Effie;Moss,RebeccaM.;Parisot,JohnP.;Yang,Hong;Czabotar,PeterE.;Fairlie,W.Douglas;Lee,ErinnaF.;Adams,JerryM.;Chen,Lin;VanDelft,MarkF.;Lowes,KymN.;Wei,Andrew;Huang,DavidC.S.;Colman,PeterM.;Street,IanP.;Baell,JonathanB.;Watson,Keith;Lessene,Guillaume[JournalofMedicinalChemistry,2013,vol.56,#13,p.5514-5540]

[4]CurrentPatentAssignee:THEWALTERANDELIZAHALLINSTITUTEOFMEDICALRESEARCH-WO2009/39553,2009,A1Locationinpatent:Page/Pagecolumn83

[5]CurrentPatentAssignee:SINOCHEMHOLDINGSCORPORATIONLTD;Syngenta(in:SinochemHoldings)-WO2021/9026,2021,A1Locationinpatent:Page/Pagecolumn56

[1]CurrentPatentAssignee:THEWALTERANDELIZAHALLINSTITUTEOFMEDICALRESEARCH-WO2009/39553,2009,A1Locationinpatent:Page/Pagecolumn111

[1]Patent:WO2009/39553,2009,A1.Locationinpatent:Page/Pagecolumn107

[1]Patent:WO2009/39553,2009,A1.Locationinpatent:Page/Pagecolumn87

[1]Patent:WO2009/39553,2009,A1.Locationinpatent:Page/Pagecolumn106

Literature
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SDS
Tags:1135871-91-8 Molecular Formula|1135871-91-8 MDL|1135871-91-8 SMILES|1135871-91-8 7-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydro-2H-naphthalen-1-one