Home Aldehydes 3558-17-6
3558-17-6,MFCD00216481
Catalog No.:AA00C79T

3558-17-6 | 2-Methyl-5-nitro-1h-indole-3-carbaldehyde

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1g
98%(HPLC)
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$93.00   $65.00
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5g
98%(HPLC)
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$361.00   $253.00
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  • Technical Information
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  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA00C79T
Chemical Name:
2-Methyl-5-nitro-1h-indole-3-carbaldehyde
CAS Number:
3558-17-6
Molecular Formula:
C10H8N2O3
Molecular Weight:
204.1821
MDL Number:
MFCD00216481
SMILES:
O=Cc1c(C)[nH]c2c1cc(cc2)[N+](=O)[O-]
Properties
Properties
 
BP:
439.849 °C at 760 mmHg  
Form:
Solid  
MP:
305-307(dec.)  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
276  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.7  

Downstream Synthesis Route

[1]Thanetchaiyakup,Adisak;Rattanarat,Hassayaporn;Chuanopparat,Nutthawat;Ngernmeesri,Paiboon[TetrahedronLetters,2018,vol.59,#11,p.1014-1018]

[2]CurrentPatentAssignee:SUNYAT-SENUNIVERSITY(CHINA);CHINESEACADEMYOFSCIENCES;ShanghaiInstituteofMateriaMedica(in:CAS)-CN113248481,2021,ALocationinpatent:Paragraph0428;0430-0431

[3]Krichevskii,E.S.;Alekseeva,L.M.;Granik,V.G.[ChemistryofHeterocyclicCompounds,1990,vol.26,#11,p.1235-1238][KhimiyaGeterotsiklicheskikhSoedinenii,1990,vol.26,#11,p.1483-1486]

[4]Borwornpinyo,Suparerk;Chuanopparat,Nutthawat;Jearawuttanakul,Kedchin;Kanjanasirirat,Phongthon;Ngernmeesri,Paiboon;Rattanarat,Hassayaporn;Seemakhan,Sawinee;Thanetchaiyakup,Adisak[TetrahedronLetters,2021,vol.82]

3558-17-6    2827-56-7   
1-1-(2-Methyl-5-nitro-1H-indol-3-yl)-meth-(E)-ylidene-amino}-imidazolidine-2,4-dione 

[1]ArchivderPharmazie,1988,vol.321,p.377-383

3558-17-6    219851-87-3   
2-<i>tert</i>-butoxycarbonylamino-3-(3-formyl-2-methyl-5-nitro-indol-1-yl)-acrylicacidmethylester 

[1]Ferreira;Maia;Monteiro;Sacramento[TetrahedronLetters,2000,vol.41,#39,p.7437-7441]

3558-17-6    1809-10-5   
2-methyl-5-nitro-1-(pentyl-3-yl)-1H-indole-3-carbaldehyde 

[1]CurrentPatentAssignee:CHINESEACADEMYOFSCIENCES;ShanghaiInstituteofMateriaMedica(in:CAS);SUNYAT-SENUNIVERSITY(CHINA)-CN113248481,2021,ALocationinpatent:Paragraph0428;0430;0432-0433

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