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1135282-93-7,MFCD11840964
Catalog No.:AA008T8F

1135282-93-7 | Methyl 4-propionyl-1H-pyrrole-2-carboxylate

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250mg
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008T8F
Chemical Name:
Methyl 4-propionyl-1H-pyrrole-2-carboxylate
CAS Number:
1135282-93-7
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD11840964
SMILES:
CCC(=O)c1c[nH]c(c1)C(=O)OC
Properties
Computed Properties
 
Complexity:
215  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.1  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartAronov,AlexM.;Qing,Tang;Martinez-Botella,Gabriel;Bemis,GuyW.;Cao,Jingrong;Chen,Guanjing;Ewing,NigelP.;Ford,PamellaJ.;Germann,UrsulaA.;Green,Jeremy;Hale,MichaelR.;Jacobs,Marc;Janetka,JamesW.;Maltais,Francois;Markland,William;Namchuk,MarkN.;Nanthakumar,Suganthini;Poondru,Srinivasu;Straub,Judy;TerHaar,Ernst;Xiaoling,Xie[JournalofMedicinalChemistry,2009,vol.52,#20,p.6362-6368]

[1]Locationinpatent:experimentalpartAronov,AlexM.;Qing,Tang;Martinez-Botella,Gabriel;Bemis,GuyW.;Cao,Jingrong;Chen,Guanjing;Ewing,NigelP.;Ford,PamellaJ.;Germann,UrsulaA.;Green,Jeremy;Hale,MichaelR.;Jacobs,Marc;Janetka,JamesW.;Maltais,Francois;Markland,William;Namchuk,MarkN.;Nanthakumar,Suganthini;Poondru,Srinivasu;Straub,Judy;TerHaar,Ernst;Xiaoling,Xie[JournalofMedicinalChemistry,2009,vol.52,#20,p.6362-6368]

[1]Tiwari,DipakKumar;Pogula,Jaya;Sridhar;Tiwari,DharmendraKumar;Likhar,PravinR.[ChemicalCommunications,2015,vol.51,#71,p.13646-13649]

Literature
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Tags:1135282-93-7 Molecular Formula|1135282-93-7 MDL|1135282-93-7 SMILES|1135282-93-7 Methyl 4-propionyl-1H-pyrrole-2-carboxylate