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29786-45-6,MFCD00297175
Catalog No.:AA00BJM0

29786-45-6 | 1-(4-Methoxyphenyl)cyclobutanecarbonitrile

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100mg
98+%
in stock  
$6.00   $4.00
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250mg
98+%
in stock  
$14.00   $10.00
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1g
98+%
in stock  
$52.00   $36.00
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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA00BJM0
Chemical Name:
1-(4-Methoxyphenyl)cyclobutanecarbonitrile
CAS Number:
29786-45-6
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD00297175
SMILES:
COc1ccc(cc1)C1(CCC1)C#N
Properties
Computed Properties
 
Complexity:
240  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
2.4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:CHONGKUNDANGPHARMACEUTICALCORP.-KR2017/43091,2017,ALocationinpatent:Paragraph0286;0290-0292

[2]CurrentPatentAssignee:PFIZERINC-US3526656,1970,A[Chem.Abstr.,1970,vol.73,#109539][Chem.Abstr.,1970,vol.73,#109539]

[1]Mndzhoyan,Sh.L.;Tsinker,M.G.;Ovakimyan,A.R.;Ter-Zakharyan,Yu.Z.;Kazaryan,E.V.;Paronikyan,R.V.[PharmaceuticalChemistryJournal,1980,vol.14,#2,p.114-118][Khimiko-FarmatsevticheskiiZhurnal,1980,vol.14,#2,p.40-45]

[2]Wolf,RichardA.;Trocino,RichardJ.;Rozich,WilliamR.;Sabeta,IsidoreC.;OrdwayJr.,RichardJ.[JournalofOrganicChemistry,1998,vol.63,#12,p.3814-3820]

[3]CurrentPatentAssignee:ABBVIEINC;WALGREENSBOOTSALLIANCE,INC.,-US5519034,1996,A

[4]Chen,Xiang;Chen,Lili;Zhao,Hongliang;Gao,Qian;Shen,Zhenlu;Xu,Senmiao[ChineseJournalofChemistry,2020,vol.38,#12,p.1533-1537]

[1]Too,PeiChui;Chan,GuoHao;Tnay,YaLin;Hirao,Hajime;Chiba,Shunsuke[AngewandteChemie-InternationalEdition,2016,vol.55,#11,p.3719-3723][Angew.Chem.,2016,vol.128,#11,p.3783-3787,5]

[2]CurrentPatentAssignee:CHONGKUNDANGHOLDINGSCORP.-KR2017/43091,2017,ALocationinpatent:Paragraph0286-0289

[3]Mndzhoyan,Sh.L.;Tsinker,M.G.;Ovakimyan,A.R.;Ter-Zakharyan,Yu.Z.;Kazaryan,E.V.;Paronikyan,R.V.[PharmaceuticalChemistryJournal,1980,vol.14,#2,p.114-118][Khimiko-FarmatsevticheskiiZhurnal,1980,vol.14,#2,p.40-45]

[4]Wolf,RichardA.;Trocino,RichardJ.;Rozich,WilliamR.;Sabeta,IsidoreC.;OrdwayJr.,RichardJ.[JournalofOrganicChemistry,1998,vol.63,#12,p.3814-3820]

[5]Barbasiewicz,Michał;Marciniak,Karolina;Fedoryński,Michał[TetrahedronLetters,2006,vol.47,#23,p.3871-3874]

[6]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-US2003/50309,2003,A1

[7]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-US2005/80078,2005,A1

[8]Chen,Xiang;Chen,Lili;Zhao,Hongliang;Gao,Qian;Shen,Zhenlu;Xu,Senmiao[ChineseJournalofChemistry,2020,vol.38,#12,p.1533-1537]

29786-45-6   
C15H18O4 

[1]Mndzhoyan,Sh.L.;Tsinker,M.G.;Ovakimyan,A.R.;Ter-Zakharyan,Yu.Z.;Kazaryan,E.V.;Paronikyan,R.V.[PharmaceuticalChemistryJournal,1980,vol.14,#2,p.114-118][Khimiko-FarmatsevticheskiiZhurnal,1980,vol.14,#2,p.40-45]

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