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167837-57-2,MFCD09759030
Catalog No.:AA001XKX

167837-57-2 | 4-Formyl-n-methylbenzamide

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250mg
98%
in stock  
$92.00   $64.00
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1g
98%
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$268.00   $188.00
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5g
98%
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$741.00   $519.00
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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:
AA001XKX
Chemical Name:
4-Formyl-n-methylbenzamide
CAS Number:
167837-57-2
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD09759030
SMILES:
CNC(=O)c1ccc(cc1)C=O
Properties
Computed Properties
 
Complexity:
171  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.6  

Downstream Synthesis Route

[1]Abe,Yoshito;Kayakiri,Hiroshi;Satoh,Shigeki;Inoue,Takayuki;Sawada,Yuki;Inamura,Noriaki;Asano,Masayuki;Hatori,Chie;Sawai,Hiroe;Oku,Teruo;Tanaka,Hirokazu[JournalofMedicinalChemistry,1998,vol.41,#21,p.4053-4061]

[1]Abe,Yoshito;Kayakiri,Hiroshi;Satoh,Shigeki;Inoue,Takayuki;Sawada,Yuki;Inamura,Noriaki;Asano,Masayuki;Hatori,Chie;Sawai,Hiroe;Oku,Teruo;Tanaka,Hirokazu[JournalofMedicinalChemistry,1998,vol.41,#21,p.4053-4061]

[2]Baker,JenniferR.;Blaskovich,MarkA.T.;Cooper,MatthewA.;Cossar,PeterJ.;Elliott,AlyshaG.;Lewis,PeterJ.;McCluskey,Adam;Zuegg,Johannes[Molecules,2022,vol.27,#7]

[1]Salfetnikova;Vasil'ev;Rudenko[RussianJournalofOrganicChemistry,1998,vol.34,#6,p.838-844]

31469-15-5    167837-57-2   
methyl3-hydroxy-2,2-dimethyl-3-(4-methylcarbamoyl)propionate 

[1]Nakagawa,Takashi;Fujisawa,Hidehiko;Mukaiyama,Teruaki[ChemistryLetters,2003,vol.32,#8,p.696-697]

[2]Nakagawa,Takashi;Fujisawa,Hidehiko;Nagata,Yuzo;Mukaiyama,Teruaki[BulletinoftheChemicalSocietyofJapan,2004,vol.77,#8,p.1555-1567]

[1]Abe,Yoshito;Kayakiri,Hiroshi;Satoh,Shigeki;Inoue,Takayuki;Sawada,Yuki;Inamura,Noriaki;Asano,Masayuki;Hatori,Chie;Sawai,Hiroe;Oku,Teruo;Tanaka,Hirokazu[JournalofMedicinalChemistry,1998,vol.41,#21,p.4053-4061]

[2]CurrentPatentAssignee:ASTELLASPHARMAINC.-US5563162,1996,A

[3]Baker,JenniferR.;Blaskovich,MarkA.T.;Cooper,MatthewA.;Cossar,PeterJ.;Elliott,AlyshaG.;Lewis,PeterJ.;McCluskey,Adam;Zuegg,Johannes[Molecules,2022,vol.27,#7]

Literature
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SDS
Tags:167837-57-2 Molecular Formula|167837-57-2 MDL|167837-57-2 SMILES|167837-57-2 4-Formyl-n-methylbenzamide