3,4'-Dimethylbenzhydrol

Base Information

• Chemical Name: 3,4'-Dimethylbenzhydrol
• CAS No.: 13389-73-6
• Molecular Formula: C15H16O
• Molecular Weight: 212.291
• Hs Code.: 2902909090
• DSSTox Substance ID: DTXSID60374375
• Mol file: 13389-73-6.mol

Synonyms:3,4'-Dimethylbenzhydrol;13389-73-6;(3-methylphenyl)-(4-methylphenyl)methanol;3,4/'-DIMETHYLBENZHYDROL;m-tolyl(p-tolyl)methanol;SCHEMBL822299;DTXSID60374375;AKOS003584068;AKOS022305016

Chemical Property of 3,4'-Dimethylbenzhydrol

Chemical Property:

• PSA: 20.23000
• LogP: 3.38510
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 212.120115130
• Heavy Atom Count: 16
• Complexity: 206

Purity/Quality:

98%min ^*data from raw suppliers

3,4'-DIMETHYLBENZHYDROL ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(C2=CC=CC(=C2)C)O

Technology Process of 3,4'-Dimethylbenzhydrol

There total 4 articles about 3,4'-Dimethylbenzhydrol 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: 95.0%

3-Iodotoluene (625-95-6) + 4-methyl-benzaldehyde (104-87-0) → 3-methyl-α-(4-methylphenyl)benzenemethanol (13389-73-6)

Guidance literature:

3-Iodotoluene; With TurboGrignard; In tetrahydrofuran; at 20 ℃;

4-methyl-benzaldehyde; In tetrahydrofuran; at 20 ℃; under 7757.43 Torr;

With ammonium chloride; In tetrahydrofuran; water;

DOI:10.1021/op200275d

Reference yield:

3,4'-dimethylbenzophenone (13152-94-8) → 3-methyl-α-(4-methylphenyl)benzenemethanol (13389-73-6)

Guidance literature:

With sodium tetrahydroborate; In isopropyl alcohol;

Reference yield:

C15H15(1+) → 3-methyl-α-(4-methylphenyl)benzenemethanol (13389-73-6)

Guidance literature:

With water; In sulfuric acid; acetic acid; Equilibrium constant;

upstream raw materials:

3,4'-dimethylbenzophenone

3-Iodotoluene

4-methyl-benzaldehyde

Refernces

• 1、 Brodmann, Tobias,Koos, Peter,Metzger, Albrecht,Knochel, Paul,Ley, Steven V.. "Continuous preparation of arylmagnesium reagents in flow with inline IR monitoring". experimental part. p. 1102 - 1113. Retrieved 2012/08/27.