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Home Other Building Blocks 76635-31-9
76635-31-9,MFCD09971317
Catalog No.:AA003JYH

76635-31-9 | 4-(3-Methyl-1,2,4-oxadiazol-5-yl)aniline

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$211.00   $148.00
- +
1g
95%
in stock  
$245.00   $172.00
- +
5g
95%
in stock  
$978.00   $685.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JYH
Chemical Name:
4-(3-Methyl-1,2,4-oxadiazol-5-yl)aniline
CAS Number:
76635-31-9
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD09971317
SMILES:
Nc1ccc(cc1)c1onc(n1)C
Properties
Properties
 
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
168  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.5  

Downstream Synthesis Route

[1]Lin,Yang-i;Lang,S.A.[JournalofHeterocyclicChemistry,1980,vol.17,p.1273-1276]

[2]Conole,Daniel;Beck,ThorstenM.;Jay-Smith,Morgan;Tingle,MalcolmD.;Eason,CharlesT.;Brimble,MargaretA.;Rennison,David[Bioorganicandmedicinalchemistry]

[3]Conole,Daniel;Beck,ThorstenM.;Jay-Smith,Morgan;Tingle,MalcolmD.;Eason,CharlesT.;Brimble,MargaretA.;Rennison,David[Bioorganicandmedicinalchemistry]

[4]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-EP2876105,2015,A1Locationinpatent:Paragraph0863;0864

[5]CurrentPatentAssignee:ASTRAZENECAPLC-WO2007/53094,2007,A1Locationinpatent:Page/Pagecolumn62

[6]Locationinpatent:schemeortableJin,Jian;Wang,Yonghui;Shi,Dongchuan;Wang,Feng;Fu,Wei;Davis,RoderickS.;Jin,Qi;Foley,JamesJ.;Sarau,HenryM.;Morrow,DwightM.;Moore,MichaelL.;Rivero,RalphA.;Palovich,Michael;Salmon,Michael;Belmonte,KristenE.;Busch-Petersen,Jakob[BioorganicandMedicinalChemistryLetters,2008,vol.18,#20,p.5481-5486]

[7]Xu,Congjun;Xiao,Zhanghong;Wang,Jing;Lai,Hualu;Zhang,Tao;Guan,Zilin;Xia,Meng;Chen,Meixu;Ren,Lingling;He,Yuanfeng;Gao,Yuqi;Zhao,Chunshun[JournalofMedicinalChemistry,2021,vol.64,#18,p.13312-13326]

C24H31N4O6PolS 
  76635-31-9    530-62-1   
C34H38N7O8PolS 

[1]Locationinpatent:schemeortableJin,Jian;Wang,Yonghui;Shi,Dongchuan;Wang,Feng;Fu,Wei;Davis,RoderickS.;Jin,Qi;Foley,JamesJ.;Sarau,HenryM.;Morrow,DwightM.;Moore,MichaelL.;Rivero,RalphA.;Palovich,Michael;Salmon,Michael;Belmonte,KristenE.;Busch-Petersen,Jakob[BioorganicandMedicinalChemistryLetters,2008,vol.18,#20,p.5481-5486]

[1]CurrentPatentAssignee:ASTRAZENECAPLC-WO2010/132015,2010,A1Locationinpatent:Page/Pagecolumn59

705-21-5    76635-31-9   
C15H11Cl2N3O3S 

[1]Chen,JianJeffrey;Qian,Wenyuan;Biswas,Kaustav;Yuan,Chester;Amegadzie,Albert;Liu,Qingyian;Nixey,Thomas;Zhu,Joe;Ncube,Mqhele;Rzasa,RobertM.;Chavez,Frank;Chen,Ning;Demorin,Frenel;Rumfelt,Shannon;Tegley,ChristopherM.;Allen,JenniferR.;Hitchcock,Stephen;Hungate,Randy;Bartberger,MichaelD.;Zalameda,Leeanne;Liu,Yichin;McCarter,JohnD.;Zhang,Jianhua;Zhu,Li;Babu-Khan,Safura;Luo,Yi;Bradley,Jodi;Wen,PaulH.;Reid,DarrenL.;Koegler,Frank;DeanJr.,Charles;Hickman,Dean;Correll,TiffanyL.;Williamson,Toni;Wood,Stephen[BioorganicandMedicinalChemistryLetters,2013,vol.23,#23,p.6447-6454]

[1]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-EP2876105,2015,A1

Literature
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SDS
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Tags:76635-31-9 Molecular Formula|76635-31-9 MDL|76635-31-9 SMILES|76635-31-9 4-(3-Methyl-1,2,4-oxadiazol-5-yl)aniline |Heterocyclic_Building_Blocks