{Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol

Base Information

• Chemical Name: {Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol
• CAS No.: 110316-12-6
• Molecular Formula: C19H24O6
• Molecular Weight: 348.39000
• DSSTox Substance ID: DTXSID50552226
• Wikidata: Q82432325
• Mol file: 110316-12-6.mol

Synonyms:110316-12-6;DTXSID50552226;{Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol;1,3-bis(4-hydroxymethyl-methoxyphenoxy) propane

Chemical Property of {Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol

Chemical Property:

• Melting Point: 153 °C(Solv: isopropanol (67-63-0))
• Boiling Point: 527.2±45.0 °C(Predicted)
• PSA: 77.38000
• Density: 1.199±0.06 g/cm3(Predicted)
• LogP: 2.53630
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 348.15728848
• Heavy Atom Count: 25
• Complexity: 321

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=CC(=C1)CO)OCCCOC2=C(C=C(C=C2)CO)OC

Technology Process of {Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol

There total 3 articles about {Propane-1,3-diylbis[oxy(3-methoxy-4,1-phenylene)]}dimethanol 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: 65.0%

4-hydroxymethyl-2-methoxyphenol (498-00-0) + 1,3-dibromo-propane (109-64-8) → 1,3-bis<4-(hydroxymethyl)-2-methoxyphenoxy>propane (110316-12-6)

Guidance literature:

With sodium hydroxide; In ethanol; for 3h; Heating;

DOI:10.1039/C39880000582

Reference yield: 60.0%

4-hydroxymethyl-2-methoxyphenol (498-00-0) + 1,3-dibromo-propane (109-64-8) → 4-(3-bromopropoxy)-3-methoxyphenyl methanol (110316-11-5) + 1,3-bis<4-(hydroxymethyl)-2-methoxyphenoxy>propane (110316-12-6)

Guidance literature:

With potassium carbonate; In acetone; for 15h; Heating;

DOI:10.1021/ja00255a035

Reference yield:

4-[3-(4-formyl-2-methoxyphenoxy)propoxy]-3-methoxybenzaldehyde (101913-37-5) → 1,3-bis<4-(hydroxymethyl)-2-methoxyphenoxy>propane (110316-12-6)

Guidance literature:

With methanol; sodium tetrahydroborate;

DOI:10.1016/j.saa.2009.10.004

upstream raw materials:

4-hydroxymethyl-2-methoxyphenol

1,3-dibromo-propane

4-[3-(4-formyl-2-methoxyphenoxy)propoxy]-3-methoxybenzaldehyde

Downstream raw materials:

cryptophane-E