Home Aldehydes 68885-46-1
68885-46-1,MFCD04973392
Catalog No.:AA006FW0

68885-46-1 | 3-Methoxy-4-(methylthio)benzaldehyde

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250mg
97%
1 week  
$185.00   $129.00
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500mg
97%
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$239.00   $167.00
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  • Technical Information
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  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA006FW0
Chemical Name:
3-Methoxy-4-(methylthio)benzaldehyde
CAS Number:
68885-46-1
Molecular Formula:
C9H10O2S
Molecular Weight:
182.2395
MDL Number:
MFCD04973392
SMILES:
COc1cc(C=O)ccc1SC
Properties
Computed Properties
 
Complexity:
150  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
2.1  

Downstream Synthesis Route
methylcrotonate 
  68885-46-1   
(2E,4E)-5-(3-Methoxy-4-methylsulfanyl-phenyl)-penta-2,4-dienoicacid 

[1]Wong;Sasso;Jones;Kaminski[JournalofMedicinalChemistry,1984,vol.27,#1,p.20-27]

[1]Wong;Sasso;Jones;Kaminski[JournalofMedicinalChemistry,1984,vol.27,#1,p.20-27]

624-92-0    124639-29-8    68885-46-1    105479-90-1   
3-methoxy-2-(methylthio)benzaldehyde 
 
4-methoxy-2,6-dimethylthiobenzaldehyde 

[1]Bevan,FionaM.;Euerby,MelvinR.;Qureshi,ShaunJ.[JournalofChemicalResearch,Miniprint,1989,#5,p.901-920]

624-92-0    124639-29-8    68885-46-1   
3-methoxy-2-(methylthio)benzaldehyde 

[1]Bevan,FionaM.;Euerby,MelvinR.;Qureshi,ShaunJ.[JournalofChemicalResearch,Miniprint,1989,#5,p.901-920]

[1]Wong;Sasso;Jones;Kaminski[JournalofMedicinalChemistry,1984,vol.27,#1,p.20-27]

[2]Stefański,Tomasz;Mikstacka,Renata;Kurczab,Rafał;Dutkiewicz,Zbigniew;Kucińska,Małgorzata;Murias,Marek;Zielińska-Przyjemska,Małgorzata;Cichocki,Michał;Teubert,Anna;Kaczmarek,Mariusz;Hogendorf,Adam;Sobiak,Stanisław[EuropeanJournalofMedicinalChemistry,2018,vol.144,p.797-816]

Literature
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SDS
Tags:68885-46-1 Molecular Formula|68885-46-1 MDL|68885-46-1 SMILES|68885-46-1 3-Methoxy-4-(methylthio)benzaldehyde