1,2-Propanediol, 3-(p-hydroxyphenoxy)-

Base Information

• Chemical Name: 1,2-Propanediol, 3-(p-hydroxyphenoxy)-
• CAS No.: 22402-45-5
• Molecular Formula: C9H12 O4
• Molecular Weight: 184.192
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID60176937
• Wikidata: Q83047268
• Mol file: 22402-45-5.mol

Synonyms:1,2-Propanediol, 3-(p-hydroxyphenoxy)-;BRN 2366226;SCHEMBL10748557;DTXSID60176937

Chemical Property of 1,2-Propanediol, 3-(p-hydroxyphenoxy)-

Chemical Property:

• Vapor Pressure: 8.19E-08mmHg at 25°C
• Boiling Point: 420.2°Cat760mmHg
• Flash Point: 208°C
• PSA: 69.92000
• Density: 1.313g/cm³
• LogP: 0.12420
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 184.07355886
• Heavy Atom Count: 13
• Complexity: 128

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1O)OC(CO)CO

Technology Process of 1,2-Propanediol, 3-(p-hydroxyphenoxy)-

There total 3 articles about 1,2-Propanediol, 3-(p-hydroxyphenoxy)- 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:

3-(4-methoxyphenoxy)-1,2-propanediol (17131-52-1) → rac-3-(4-hydroxyphenoxy)propane-1,2-diol (22402-45-5)

Guidance literature:

With hydrogen bromide; In water; at 50 ℃;

DOI:10.1016/j.mencom.2019.03.028

Reference yield:

hydroquinone (123-31-9,8027-02-9) + 3-monochloro-1,2-propanediol (96-24-2) → rac-3-(4-hydroxyphenoxy)propane-1,2-diol (22402-45-5)

Guidance literature:

With sodium ethanolate; In ethanol;

Reference yield:

sodium 4-hydroxybenzen-1-olate (30008-10-7) + 3-monochloro-1,2-propanediol (96-24-2) → rac-3-(4-hydroxyphenoxy)propane-1,2-diol (22402-45-5)

Guidance literature:

With ethanol;

upstream raw materials:

sodium 4-hydroxybenzen-1-olate

3-monochloro-1,2-propanediol

hydroquinone

3-(4-methoxyphenoxy)-1,2-propanediol

Downstream raw materials:

3-(4-hexyloxyphenoxy)propane-1,2-diol

3-(4-Octyloxy-phenoxy)-propandiol-(1,2)

prenalterol

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