(4-Iodo-3-methylphenyl)methanol

Base Information

• Chemical Name: (4-Iodo-3-methylphenyl)methanol
• CAS No.: 959632-18-9
• Molecular Formula: C₈H₉IO
• Molecular Weight: 248.063
• DSSTox Substance ID: DTXSID301305634
• Mol file: 959632-18-9.mol

Synonyms:(4-iodo-3-methylphenyl)methanol;959632-18-9;(4-Iodo-3-methyl-phenyl)-methanol;Benzenemethanol, 4-iodo-3-methyl-;4-iodo-3-methylBenzenemethanol;SCHEMBL171208;4-Iodo-3-methylbenzyl alcohol;GKVHYRRQQVUDKB-UHFFFAOYSA-N;DTXSID301305634;CS-0378772;FT-0731793;EN300-193484

Chemical Property of (4-Iodo-3-methylphenyl)methanol

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 247.96981
• Heavy Atom Count: 10
• Complexity: 105

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)CO)I

Technology Process of (4-Iodo-3-methylphenyl)methanol

There total 2 articles about (4-Iodo-3-methylphenyl)methanol 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%

4-iodo-3-methylbenzoic acid (52107-87-6) → (4-iodo-3-methylphenyl)methanol (959632-18-9)

Guidance literature:

4-iodo-3-methylbenzoic acid; With dimethylsulfide borane complex; In tetrahydrofuran;

With methanol; In tetrahydrofuran; at 0 ℃;

Reference yield:

4-bromo-3-methylbenzylalcohol (149104-89-2) → (4-iodo-3-methylphenyl)methanol (959632-18-9)

Guidance literature:

With copper(l) iodide; sodium iodide; N,N`-dimethylethylenediamine; In 1,4-dioxane; at 120 ℃;

DOI:10.1016/j.bmcl.2015.05.065

Reference yield: 56.0%

(4-iodo-3-methylphenyl)methanol (959632-18-9) + -butyl vinyl ether (111-34-2,92680-80-3) → 1-(4-hydroxymethyl-2-methyl-phenyl)-ethanone (1453499-95-0)

Guidance literature:

With 1,3-bis-(diphenylphosphino)propane; palladium diacetate; potassium carbonate; lithium chloride; In water; N,N-dimethyl-formamide; at 90 ℃; for 7h; Inert atmosphere;

upstream raw materials:

4-iodo-3-methylbenzoic acid

4-bromo-3-methylbenzylalcohol

Downstream raw materials:

4-benzyloxy-1-{2-[4-(3-hydroxy-azetidin-1-ylmethyl)-2-methyl-phenyl]-2-oxo-ethyl}-1H-pyridin-2-one

4-benzyloxy-1-{2-[4-(3-hydroxy-3-methyl-pyrrolidin-1-ylmethyl )-2-methyl-phenyl]-2-oxo-ethyl}-1H-pyridin-2-one

2-bromo-1-(4-hydroxymethyl-2-methyl-phenyl)-ethanone

4-benzyloxy-1-[2-(4-hydroxymethyl-2-methyl-phenyl)-2-oxo-ethyl]-1H-pyridin-2-one