[2-(Methoxymethyl)phenyl]methanol

Base Information

• Chemical Name: [2-(Methoxymethyl)phenyl]methanol
• CAS No.: 62172-88-7
• Molecular Formula: C9H12O2
• Molecular Weight: 152.193
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID70546581
• Nikkaji Number: J1.582.138H
• Wikidata: Q72490330
• Mol file: 62172-88-7.mol

Synonyms:62172-88-7;[2-(Methoxymethyl)phenyl]methanol;(2-(Methoxymethyl)phenyl)methanol;Benzenemethanol, 2-(methoxymethyl)- (9CI);2-(Methoxymethyl)benzyl alcohol;o-methoxymethylbenzyl alcohol;2-methoxymethylbenzyl alcohol;SCHEMBL3150243;(2-Methoxymethylphenyl)-methanol;DTXSID70546581;GYPVNVDWCITVPO-UHFFFAOYSA-N;MFCD18825431;AKOS013568390;SB84537;C16099;EN300-133492

Chemical Property of [2-(Methoxymethyl)phenyl]methanol

Chemical Property:

• Boiling Point: 238oC
• Flash Point: 96oC
• PSA: 29.46000
• Density: 1.068
• LogP: 1.32530
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 152.083729621
• Heavy Atom Count: 11
• Complexity: 104

Purity/Quality:

97% ^*data from raw suppliers

[2-(methoxymethyl)phenyl]methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COCC1=CC=CC=C1CO

Technology Process of [2-(Methoxymethyl)phenyl]methanol

There total 9 articles about [2-(Methoxymethyl)phenyl]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:

sodium methylate (124-41-4) + 2-(hydroxymethyl)benzaldehyde tosylhydrazone (125593-15-9) → 1,3-dihydroisobenzofuran (496-14-0) + 2-benzofuran-1(3H)-one (87-41-2) + 2-methyl-benzyl alcohol (89-95-2) + 2-(methoxymethyl)-benzyl alcohol (62172-88-7)

Guidance literature:

With methanol; at 25 ℃; for 1h; Further byproducts given. Yields of byproduct given; Irradiation;

DOI:10.1021/jo00295a018

Reference yield:

phthalyl alcohol (612-14-6) + methyl iodide (74-88-4) → 2-(methoxymethyl)-benzyl alcohol (62172-88-7)

Guidance literature:

With sodium hydride; In tetrahydrofuran; at 20 ℃;

DOI:10.1002/jlcr.636

Reference yield:

benzoic acid 2-methoxy-methyl ester (88550-19-0) → 2-(methoxymethyl)-benzyl alcohol (62172-88-7)

Guidance literature:

With lithium aluminium tetrahydride; diethyl ether;

DOI:10.1039/jr9540002819

upstream raw materials:

benzoic acid 2-methoxy-methyl ester

methyl 2-(methoxymethyl)benzoate

sodium methylate

2-(hydroxymethyl)benzaldehyde tosylhydrazone

Downstream raw materials:

(2-methoxymethyl-phenyl)-acetonitrile

isochroman-3-one

C₁₆H₁₇N₂O₃S^(1-)*Na⁽¹⁺⁾

2-(Methoxymethyl)benzaldehyde tosylhydrazone

Refernces

• 1、 Liu, Xuan,Zheng, Qi-Huang,Fei, Xiangshu,Wang, Ji-Quan,Ohannesian, David W.,Erickson, Leonard C.,Stone, K. Lee,Hutchins, Gary D.. "Synthesis and Preliminary Biological Evaluation of 6-O-[11C]-[(methoxymethyl)benzyl]guanines, New Potential PET Breast Cancer Imaging Agents for the DNA Pepair Protein AGT". . p. 641 - 644. Retrieved 2007/10/03.
• 2、 Zheng, Qi-Huang,Liu, Xuan,Fei, Xiangshu,Wang, Ji-Quan,Ohannesian, David W.,Erickson, Leonard C.,Stone, K. Lee,Martinez, Tanya D.,Miller, Kathy D.,Hutchins, Gary D.. "Synthesis of radiolabeled O6-benzylguanine derivatives as new potential PET tumor imaging agents for the DNA repair protein O6-alkylguanine-DNA alkyltransferase". . p. 1239 - 1252. Retrieved 2007/10/03.