Home Other Heterocycles 77716-01-9
77716-01-9,MFCD17926553
Catalog No.:AA00G7J2

77716-01-9 | 7-Benzyl-3-oxa-7-azabicyclo[3.3.1]nonan-9-one

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100mg
95%
in stock  
$21.00   $15.00
- +
250mg
95%
in stock  
$31.00   $22.00
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1g
95%
in stock  
$41.00   $29.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00G7J2
Chemical Name:
7-Benzyl-3-oxa-7-azabicyclo[3.3.1]nonan-9-one
CAS Number:
77716-01-9
Molecular Formula:
C14H17NO2
Molecular Weight:
231.2903
MDL Number:
MFCD17926553
SMILES:
O=C1C2COCC1CN(C2)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
270  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
2  
XLogP3:
0.9  

Downstream Synthesis Route
110-89-4    151-50-8    77716-01-9   
7-Benzyl-9-hydroxy-3-oxa-7-azabicyclo<3.3.1>nonan-9-carbonitryl 

[1]Deus-Neumann;Zenk[ArchivderPharmazie,1987,vol.320,#2,p.130-134]

29943-42-8    50-00-0    100-46-9    77716-01-9   
2,4,10,12-tetrabenzyl-2,4,10,12-tetraaza-15-oxadispiro<5.1.5.3>hexadecan-7-one 

[1]Smith,GaryS.;Berlin,K.Darrell;Zisman,StanA.;Holt,ElizabethM.;Green,VickiA.;Helm,DickVanDer[PhosphorusandSulfurandtheRelatedElements,1988,vol.39,p.91-112]

[1]Huttenloch,Oliver;Laxman,Eltepu;Waldmann,Herbert[Chemistry-AEuropeanJournal,2002,vol.8,#20,p.4767-4780]

[2]CurrentPatentAssignee:MERCK&amp;COINC-WO2010/9195,2010,A1Locationinpatent:Page/Pagecolumn87

[3]Tyagi,Sameer;Couch,KevinM.;Garrison,GregoryL.;Berlin,K.Darrell;Scherlag,BenajminJ.;Patterson,Eugene;Lazzara,Ralph[OrganicPreparationsandProceduresInternational,1999,vol.31,#4,p.413-421]

[4]CurrentPatentAssignee:ISTITUTOITALIANODITECNOLOGIA-US2019/135778,2019,A1Locationinpatent:Paragraph0092

[5]Garrison,GregoryL.;Berlin,K.Darrell;Scherlag,BenjaminJ.;Lazzara,Ralph;Patterson,Eugene;etal.[JournalofOrganicChemistry,1993,vol.58,#27,p.7670-7678]

[6]CurrentPatentAssignee:PFIZERINC-WO2010/106457,2010,A2Locationinpatent:Page/Pagecolumn24

[7]CurrentPatentAssignee:PFIZERINC-WO2010/128414,2010,A1Locationinpatent:Page/Pagecolumn49-50

[8]Locationinpatent:experimentalpartMcClure,KimF.;Darout,Etzer;Guimarães,CristianoR.W.;Deninno,MichaelP.;Mascitti,Vincent;Munchhof,MichaelJ.;Robinson,RalphP.;Kohrt,Jeffrey;Harris,AnthonyR.;Moore,DiannaE.;Li,Bryan;Samp,Lacey;Lefker,BruceA.;Futatsugi,Kentaro;Kung,Daniel;Bonin,PaulD.;Cornelius,Peter;Wang,Ruduan;Salter,Eben;Hornby,Sam;Kalgutkar,AmitS.;Chen,Yue[JournalofMedicinalChemistry,2011,vol.54,#6,p.1948-1952]

[9]CurrentPatentAssignee:MERCK&amp;COINC-WO2016/144846,2016,A1Locationinpatent:Page/Pagecolumn79;80

77716-01-9   
7-Benzyl-3-oxa-7,9-diazabicyclo<3.3.2>decan-10-one 

[1]Garrison,GregoryL.;Berlin,K.Darrell;Scherlag,BenjaminJ.;Lazzara,Ralph;Patterson,Eugene;etal.[JournalofOrganicChemistry,1993,vol.58,#27,p.7670-7678]

[2]Locationinpatent:experimentalpartMityuk,AndreyP.;Denisenko,AleksandrV.;Dacenko,OleksandrP.;Grygorenko,OleksandrO.;Mykhailiuk,PavelK.;Volochnyuk,DmitriyM.;Tolmachev,AndreyA.[TetrahedronLetters,2010,vol.51,#13,p.1790-1792]

[3]CurrentPatentAssignee:MERCK&amp;COINC-WO2008/143856,2008,A1Locationinpatent:Page/Pagecolumn35-36

[4]CurrentPatentAssignee:MERCK&amp;COINC-WO2016/144846,2016,A1Locationinpatent:Page/Pagecolumn80

77716-01-9   
7-Benzyl-3,9-dioxa-7-azabicyclo<3.3.2>decan-10-one 

[1]Garrison,GregoryL.;Berlin,K.Darrell;Scherlag,BenjaminJ.;Lazzara,Ralph;Patterson,Eugene;etal.[JournalofOrganicChemistry,1993,vol.58,#27,p.7670-7678]

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SDS
Tags:77716-01-9 Molecular Formula|77716-01-9 MDL|77716-01-9 SMILES|77716-01-9 7-Benzyl-3-oxa-7-azabicyclo[3.3.1]nonan-9-one