Ethyl 3,3-diethoxypropionate

Base Information

• Chemical Name: Ethyl 3,3-diethoxypropionate
• CAS No.: 10601-80-6
• Molecular Formula: C9 H18 O4
• Molecular Weight: 190.24
• Hs Code.: 29189900
• European Community (EC) Number: 234-223-1
• NSC Number: 83149
• UNII: 949D397DXS
• DSSTox Substance ID: DTXSID70147476
• Nikkaji Number: J208.450C
• Wikidata: Q72474306
• Mol file: 10601-80-6.mol

Synonyms:Ethyl 3,3-diethoxypropionate;10601-80-6;Ethyl 3,3-diethoxypropanoate;3,3-Diethoxypropionic Acid Ethyl Ester;ETHYL3,3-DIETHOXYPROPIONATE;Propanoic acid, 3,3-diethoxy-, ethyl ester;MFCD00009865;AI3-22276;949D397DXS;EINECS 234-223-1;NSC-83149;3,3-Diethoxy-propionic acid ethyl ester;ethyl-3,3-diethoxypropionate;NCIOpen2_001167;ethyl 3.3-diethoxypropanoate;SCHEMBL204730;UNII-949D397DXS;ethyl 3,3-diethoxy-propanoate;ethyl 3,3-diethoxy-propionate;Ethyl 3,3-diethoxypropanoate #;SIALOQYKFQEKOG-UHFFFAOYSA-;DTXSID70147476;Ethyl beta,beta-diethoxypropionate;BCP26807;NSC83149;CL4507;NSC 83149;STL195590;AKOS005137982;AC-1404;CS-W015890;PB19867;AS-11094;BP-12776;beta,beta-diethoxypropionic acid ethyl ester;AM20080007;D1962;FT-0614051;Malonaldehydic acid ethyl ester diethylacetal;EN300-43929;Ethyl 3,3-diethoxypropionate, 90%, technical grade;W-108775;F0001-0131;Z445152476;ethyl 3,3-diethoxypropanoate

Chemical Property of Ethyl 3,3-diethoxypropionate

Chemical Property:

• Appearance/Colour: Clear liquid
• Vapor Pressure: 0.205mmHg at 25°C
• Melting Point: 200-202 °C
• Refractive Index: n20/D 1.411(lit.)
• Boiling Point: 209.3 ºC at 760 mmHg
• Flash Point: 84.4 ºC
• PSA: 44.76000
• Density: 0.982 g/cm³
• LogP: 1.33870
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 190.12050905
• Heavy Atom Count: 13
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

Ethyl 3,3-diethoxypropionate ^*data from reagent suppliers

Safty Information:

• Safety Statements: 23-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCOC(CC(=O)OCC)OCC
• uses: Ethyl 3,3-diethoxypropionate participates in the Yb(OTf)3 catalyzed synthesis of dihydropyridines (DHPs).

Technology Process of Ethyl 3,3-diethoxypropionate

There total 75 articles about Ethyl 3,3-diethoxypropionate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

ethanol (64-17-5) + cellulose (9004-34-6) → ethyl 3-furancarboxylate (614-98-2) + ethyl 3,3-diethoxypropanoate (10601-80-6) + diethyl Fumarate (623-91-6) + Diethyl maleate (141-05-9) + succinic acid diethyl ester (123-25-1)

Guidance literature:

With H⁽¹⁺⁾*O₄₀PW₁₂^(3-)*Cu⁽²⁺⁾; oxygen; at 170 ℃; for 4h; under 7500.75 Torr; Autoclave;

DOI:10.1039/d1gc03114g

Reference yield:

ethanol (64-17-5) + D-glucose (50-99-7) → ethyl 3-furancarboxylate (614-98-2) + malondialdehyde bis(diethyl acetal) (122-31-6) + ethyl 3,3-diethoxypropanoate (10601-80-6) + 4-oxopentanoic acid ethyl ester (539-88-8) + oxalic acid diethyl ester (95-92-1) + diethyl malonate (105-53-3) + diethyl Fumarate (623-91-6) + Ethyl diethoxyacetate (6065-82-3) + Diethyl maleate (141-05-9) + succinic acid diethyl ester (123-25-1)

Guidance literature:

With oxygen; O₄₀PW₁₂^(3-)*Cu⁽²⁺⁾*C₈H₁₅N₂O₃S⁽¹⁺⁾; at 170 ℃; for 4h; under 7500.75 Torr; Autoclave;

DOI:10.1039/d1gc03114g

Reference yield:

ethanol (64-17-5) + cellulose (9004-34-6) → ethyl 3-furancarboxylate (614-98-2) + malondialdehyde bis(diethyl acetal) (122-31-6) + ethyl 3-ethoxypropionate (763-69-9) + ethyl 3,3-diethoxypropanoate (10601-80-6) + 4-oxopentanoic acid ethyl ester (539-88-8) + oxalic acid diethyl ester (95-92-1) + diethyl malonate (105-53-3) + diethyl Fumarate (623-91-6) + Ethyl diethoxyacetate (6065-82-3) + Diethyl maleate (141-05-9) + succinic acid diethyl ester (123-25-1)

Guidance literature:

With oxygen; O₄₀PW₁₂^(3-)*Cu⁽²⁺⁾*C₈H₁₅N₂O₃S⁽¹⁺⁾; at 170 ℃; for 4h; under 7500.75 Torr; Autoclave;

DOI:10.1039/d1gc03114g

upstream raw materials:

Ethyl-(1,3,3,3-tetrachlor-propyl)-ether

1,1,1,3-tetrachloro-3-acetoxypropane

ethanol

ethyl 3-ethoxyacrylate

Downstream raw materials:

ethyl (E)-3-(benzyloxy)propenoate

benzyl (E)-benzyloxyacrylate

7-hydroxy-5-methyl-chromen-2-one

3,3-bis-(4-hydroxy-phenyl)-propionic acid ethyl ester

Refernces

• 1、 Israel,Zoll,Muhammad,Modest. "Synthesis and antitumor evaluation of the presumed cytotoxic metabolites of spermine and N,N'-bis(3-aminopropyl)nonane-1,9-diamine.". . p. 1 - 5. Retrieved 1973.
• 2、 McElvain,Clarke. "-". . p. 2660. Retrieved 1947.
• 3、 Stumpf, Tim-Daniel J.,Steinbach, Manfred,H?ltke, Magdalene,Heuger, Gerold,Grasemann, Franka,Fr?hlich, Roland,Schindler, Siegfried,G?ttlich, Richard. "C-Bridged Bispyrrolidines and Bispiperidines as New Ligands". . p. 5538 - 5547. Retrieved 2018.
• 4、 Bal, Mathias,Bomon, Jeroen,Liao, Yuhe,Maes, Bert U. W.,Sels, Bert F.,Sergeyev, Sergey,Van Den Broeck, Elias,Van Speybroeck, Veronique. "Br?nsted Acid Catalyzed Tandem Defunctionalization of Biorenewable Ferulic acid and Derivates into Bio-Catechol". supporting information. p. 3063 - 3068. Retrieved 2020/02/05.
• 5、 -. "Preparation method of uracil". Paragraph 0041-0052. . Retrieved 2019/11/20.