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609-09-6,MFCD28101749
Catalog No.:AA0034NM

609-09-6 | Diethyl ketomalonate

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1g
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5g
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10g
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$13.00   $9.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0034NM
Chemical Name:
Diethyl ketomalonate
CAS Number:
609-09-6
Molecular Formula:
C7H10O5
Molecular Weight:
174.1513
MDL Number:
MFCD28101749
SMILES:
CCOC(=O)C(=O)C(=O)OCC
NSC Number:
53478
Properties
Properties
 
BP:
209°C at 760 mmHg  
Form:
Liquid  
MP:
-70 °C  
Refractive Index:
n20/D 1.415  
Stability:
Moisture Sensitive  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
176  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
6  
XLogP3:
0.4  

Upstream Synthesis Route

[1]JournaloftheIndianChemicalSociety,1986,vol.63,p.427-429

[2]JournaloftheChemicalSociety,1945,p.622,625

[3]EuropeanJournalofMedicinalChemistry,2018,vol.154,p.101-109

[1]ArchivderPharmazie,2012,vol.345,#9,p.687-694

[1]JournaloftheChemicalSociety,1957,p.430,434

[1]Patent:US4769464,1988,A,

[2]TetrahedronLetters,1981,vol.22,#46,p.4607-4610

[1]Patent:US2016/194268,2016,A1,.Locationinpatent:Paragraph0221;0222;0223;0224;0225;0226;0227-0229

[2]Patent:CN105377803,2016,A,.Locationinpatent:Paragraph0246;0247;0248;0249;0250;0251;0252-0260

Downstream Synthesis Route

[1]JournaloftheChemicalSociety,1957,p.430,434

[1]JournalfurpraktischeChemie(Leipzig1954),1957,vol.<4>4,p.136,145

[1]JournalofHeterocyclicChemistry,1996,vol.33,p.1737-1742

[2]JournaloftheChemicalSociety,1957,p.430,434

[1]BioorganicandMedicinalChemistry,2011,vol.19,p.261-274

[2]JournalfurpraktischeChemie(Leipzig1954),1957,vol.<4>4,p.136,145

[1]JournalofOrganicChemistry,1988,vol.53,p.4773-4779

[2]CroaticaChemicaActa,1957,vol.29,p.269,272

[3]Patent:US2013/183269,2013,A1.Locationinpatent:Paragraph1490;1491

[4]Patent:WO2015/5901,2015,A1.Locationinpatent:Page/Pagecolumn583;584

Literature

Title: Synthesis, crystal structure and anticancer activity of novel derivatives of ethyl 1-(4-oxo-8-aryl-4,6,7,8-tetrahydroimidazo[2,1-c][1,2,4]triazin-3-yl)formate.

Journal: European journal of medicinal chemistry 20060401

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SDS
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