Acetic acid 3-hydroxypropyl ester

Base Information

• Chemical Name: Acetic acid 3-hydroxypropyl ester
• CAS No.: 36678-05-4
• Molecular Formula: C5H10O3
• Molecular Weight: 118.133
• Mol file: 36678-05-4.mol

Synonyms:3-acetoxypropan-1-ol;3-acetyl-1-propanol;3-hydroxypropyl acetate;3-acetoxypropanol;1,3-propanediol monoacetate;Acetic acid 3-hydroxy-propyl ester;3-acetyloxy propanol;

Chemical Property of Acetic acid 3-hydroxypropyl ester

Chemical Property:

• Boiling Point: 203 °C
• PKA: 14.79±0.10(Predicted)
• PSA: 46.53000
• Density: 1.026 g/cm3(Temp: 25 °C)
• LogP: -0.06810

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Acetic acid 3-hydroxypropyl ester

There total 6 articles about Acetic acid 3-hydroxypropyl ester 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:

Allyl acetate (591-87-7) → propan-1-ol (71-23-8) + 6-hydroxy-3-oxa-2-hexanone (36678-05-4) + trimethyleneglycol (504-63-2)

Guidance literature:

With 9-borabicyclo[3.3.1]nonane dimer; dihydrogen peroxide; sodium acetate; Product distribution; 1.) THF, 25 deg C, 2 h, 2.) room temp.;

DOI:10.1021/jo00333a009

Reference yield:

propene (187737-37-7,13987-01-4,15220-87-8,9003-07-0,676-63-1,25085-53-4) + acetic acid (64-19-7,77671-22-8) → Isopropenyl acetate (108-22-5) + Allyl acetate (591-87-7) + 2-hydroxypropyl acetate (627-69-0,82944-63-6) + 6-hydroxy-3-oxa-2-hexanone (36678-05-4) + propane-1,2-diol 2-monoacetate (6214-01-3) + (E)-1-propen-1-yl acetate (3249-50-1)

Guidance literature:

With bis(acetonitrile)chloronitropalladium(II); at 25 ℃; for 2h; Product distribution; various catalysts, times, O₂ atmosphere with 18O containing complex; further products;

DOI:10.1021/ja00298a024

Reference yield:

vinyl acetate (108-05-4,9003-20-7) + carbon monoxide (201230-82-2) → 2-acetoxypropanal (22094-23-1) + 6-hydroxy-3-oxa-2-hexanone (36678-05-4) + acetic acid (64-19-7,77671-22-8) + propionaldehyde (123-38-6)

Guidance literature:

With 2,2'-bis((diphenylphosphino)methyl)-1,1'-biphenyl; (acetylacetonato)dicarbonylrhodium (l); hydrogen; In toluene; at 110 ℃; under 37503.8 Torr; chemoselective reaction; Autoclave;

DOI:10.1016/S1872-2067(11)60384-7

upstream raw materials:

2-methyl-[1,3]dioxane

1,3-diacetoxypropane

carbon monoxide

Allyl acetate

Downstream raw materials:

3-acetoxypropanal

propylene glycol

acetic acid

trimethyleneglycol

Refernces

• 1、 Nazarov, M. N.,Kulak, L. G.,Zlot-skii, S. S.,Rakhmankulov, D. L.. "HYDROXYLATION OF 1,3-DIOXACYCLANES BY HYDROGEN PEROXIDE IN THE PRESENCE OF CARBON TETRACHLORIDE". . p. 192 - 194. Retrieved 2007/10/02.
• 2、 Kuramshin, E. M.,Gumerova, V. K.,D'yachenko, V. A.,Kulak, L. G.,Molyavko, M. A.,et al.. "SYNTHESIS OF GLYCOL MONOESTERS BY OXIDATION OF 1,3-DIOXACYCLANES". . p. 948 - 954. Retrieved 2007/10/02.