1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol

Base Information

• Chemical Name: 1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol
• CAS No.: 261930-06-7
• Molecular Formula: C11H16 O3
• Molecular Weight: 196.246
• DSSTox Substance ID: DTXSID60441713
• Nikkaji Number: J1.507.902I
• Mol file: 261930-06-7.mol

Synonyms:261930-06-7;1-(4-METHOXYPHENYL)-2-METHYLPROPANE-1,2-DIOL;1,2-Propanediol, 1-(4-methoxyphenyl)-2-methyl-;MPMP-diol;1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol.;SCHEMBL12493635;DTXSID60441713;NEPTUHIWSNKWGB-UHFFFAOYSA-N;STL386384;AKOS006329261;AB52579;1-(4-Methoxyphenyl)-2-methyl-1,2-propanediol

Chemical Property of 1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol

Chemical Property:

• Boiling Point: 345.5±32.0 °C(Predicted)
• PKA: 14.22±0.20(Predicted)
• PSA: 49.69000
• Density: 1.120±0.06 g/cm3(Predicted)
• LogP: 1.49950
• XLogP3: 1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 196.109944368
• Heavy Atom Count: 14
• Complexity: 171

Purity/Quality:

98%min ^*data from raw suppliers

1-(4-METHOXYPHENYL)-2-METHYLPROPANE-1,2-DIOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C(C1=CC=C(C=C1)OC)O)O

Technology Process of 1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol

There total 8 articles about 1-(4-Methoxyphenyl)-2-methylpropane-1,2-diol 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: 90.0%

1-methoxy-4-(2-methyl-1-propenyl)benzene (877-99-6) → 1-(4-methoxyphenyl)-1,2-dihydroxy-2-methylpropane (261930-06-7)

Guidance literature:

With osmium(VIII) oxide; 4-methylmorpholine N-oxide; In water; acetone; at 20 ℃; for 8h;

DOI:10.1016/j.tetlet.2005.10.010

Reference yield: 18.0%

methyl 4-methoxybenzoate (121-98-2) + isopropyl alcohol (67-63-0,8013-70-5) → 1-(p-methoxyphenyl)-2-methylpropan-1-ol (18228-46-1) + 1-(4-methoxyphenyl)-1,2-dihydroxy-2-methylpropane (261930-06-7) + 4-Methoxybenzyl alcohol (105-13-5)

Guidance literature:

With tetraethylammonium tosylate; Electrochemical reaction; Sn cathode; Pt anode; constant current 0.2 A; divided cell;

DOI:10.1021/jo0013599

Reference yield:

1-bromo-1-(4-methoxyphenyl)-2-methylpropan-2-ol → 1-(4-methoxyphenyl)-1,2-dihydroxy-2-methylpropane (261930-06-7)

Guidance literature:

With water; silver carbonate; In acetone;

DOI:10.1002/anie.200704597

upstream raw materials:

methyl magnesium iodide

ethyl 2-hydroxy-2-(4-methoxyphenyl)acetate

β,β-dimethyl-4-methoxystyrene oxide

methyl 4-methoxybenzoate

Downstream raw materials:

3-(4-methoxyphenyl)butan-2-one

2-hydroxy-1-(4-methoxyphenyl)-2-methyl-1-propanone