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3590-37-2,MFCD00096267
Catalog No.:AA007D79

3590-37-2 | Ethyl 3-nitropropanoate

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250mg
95%
in stock  
$322.00   $225.00
- +
1g
95%
in stock  
$727.00   $509.00
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5g
95%
in stock  
$2,016.00   $1,411.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007D79
Chemical Name:
Ethyl 3-nitropropanoate
CAS Number:
3590-37-2
Molecular Formula:
C5H9NO4
Molecular Weight:
147.1293
MDL Number:
MFCD00096267
SMILES:
[O-][N+](=O)CCC(=O)OCC
Properties
Computed Properties
 
Complexity:
128  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
4  
XLogP3:
0.2  

Downstream Synthesis Route

[1]JournalfurpraktischeChemie(Leipzig1954),1879,vol.<2>20,p.169

[1]Moss,RobertA.;Fu,Xiaolin[OrganicLetters,2004,vol.6,#19,p.3353-3356]

[2]CurrentPatentAssignee:UNIVERSITYOFROCHESTER-WO2012/92367,2012,A1Locationinpatent:Page/Pagecolumn45-46

[3]Silva;Costa;Pereira[SyntheticCommunications,2001,vol.31,#4,p.595-600]

[4]Berger,DanM.;Dutia,Minu;Birnberg,Gary;Powell,Dennis;Boschelli,DianeH.;Wang,YanongD.;Ravi,Malini;Yaczko,Deanna;Golas,Jennifer;Lucas,Judy;Boschelli,Frank[JournalofMedicinalChemistry,2005,vol.48,#19,p.5909-5920]

[5]Pelletier,SophieM.-C.;Ray,PeterC.;Dixon,DarrenJ.[OrganicLetters,2011,vol.13,#24,p.6406-6409]

[6]Burkhard,JohannesA.;Tchitchanov,BorisH.;Carreira,ErickM.[AngewandteChemie-InternationalEdition,2011,vol.50,#23,p.5379-5382]

[7]CurrentPatentAssignee:COUNCILOFSCIENTIFICANDINDUSTRIALRESEARCH(IN)-WO2012/111020,2012,A1Locationinpatent:Page/Pagecolumn42

[8]CurrentPatentAssignee:COUNCILOFSCIENTIFICANDINDUSTRIALRESEARCH(IN)-US2013/317211,2013,A1Locationinpatent:Paragraph0272

348618-24-6    110-91-8    3590-37-2    62492-42-6    4637-24-5    75-05-8   
4-(4-chloro-5-methoxy-2-methylanilino)-7-methoxy-8-2-(4-morpholinyl)ethoxybenzogquinoline-3-carbonitrile 
  348618-36-0 

[1]JournalofMedicinalChemistry,2005,vol.48,p.5909-5920

348618-24-6    110-91-8    3590-37-2    98446-49-2    4637-24-5    75-05-8   
4-(2,4-dichloro-5-methoxyanilino)-8-methoxy-7-2-(4-morpholinyl)ethoxybenzogquinoline-3-carbonitrile 
 
4-(2,4-dichloro-5-methoxyanilino)-7-methoxy-8-2-(4-morpholinyl)ethoxybenzogquinoline-3-carbonitrile 

[1]JournalofMedicinalChemistry,2005,vol.48,p.5909-5920

348618-24-6    3590-37-2    98446-49-2    4637-24-5    75-05-8   
4-hydroxypiperidine 
 
4-(2,4-Dichloro-5-methoxyanilino)-8-2-(4-hydroxy-1-piperidinyl)ethoxy-7-methoxybenzogquinoline-3-carbonitrile 
 
4-(2,4-Dichloro-5-methoxyanilino)-7-2-(4-hydroxy-1-piperidinyl)ethoxy-8-methoxybenzogquinoline-3-carbonitrile 

[1]JournalofMedicinalChemistry,2005,vol.48,p.5909-5920

Literature

Title: Double conjugate addition of a nitropropionate ester to a quinone monoketal: synthesis of an advanced intermediate to (+/-)-gelsemine.

Journal: Organic letters 20070802

Title: Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.

Journal: Organic letters 20050721

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