(2-(Dimethoxymethyl)phenyl)methanol

Base Information

• Chemical Name: (2-(Dimethoxymethyl)phenyl)methanol
• CAS No.: 87656-32-4
• Molecular Formula: C10H14 O3
• Molecular Weight: 182.219
• Hs Code.: 2909499000
• NSC Number: 382342
• DSSTox Substance ID: DTXSID40321862
• Wikidata: Q82080058
• Mol file: 87656-32-4.mol

Synonyms:(2-(Dimethoxymethyl)phenyl)methanol;87656-32-4;NSC382342;SCHEMBL3415124;2-(dimethoxymethyl)phenylmethanol;DTXSID40321862;NSC 382342;NSC-382342

Chemical Property of (2-(Dimethoxymethyl)phenyl)methanol

Chemical Property:

• Vapor Pressure: 0.0123mmHg at 25°C
• Boiling Point: 249.1°Cat760mmHg
• Flash Point: 104.4°C
• PSA: 38.69000
• Density: 1.097g/cm³
• LogP: 1.47030
• Storage Temp.: 2-8°C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 182.094294304
• Heavy Atom Count: 13
• Complexity: 134

Purity/Quality:

99% ^*data from raw suppliers

(2-(Dimethoxymethyl)phenyl)methanol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(C1=CC=CC=C1CO)OC

Technology Process of (2-(Dimethoxymethyl)phenyl)methanol

There total 5 articles about (2-(Dimethoxymethyl)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: 83.0%

methyl 2-(dimethoxymethyl)benzoate (87656-31-3) → (2-(dimethoxymethyl)phenyl)methanol (87656-32-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 12h; Ambient temperature;

DOI:10.1021/jo00174a041

Reference yield: 48.0%

2-(dimethoxymethyl)benzaldehyde (132233-84-2) → (2-(dimethoxymethyl)phenyl)methanol (87656-32-4)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 20 ℃; for 1.41667h; Inert atmosphere; Cooling with ice;

Reference yield:

o-carboxybenzaldehyde (119-67-5) → (2-(dimethoxymethyl)phenyl)methanol (87656-32-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 97 percent / trimethyl orthoformate, Dowex 50W-X₈ resin / 15 h / Heating

2: 83 percent / LAH / diethyl ether / 12 h / Ambient temperature

With lithium aluminium tetrahydride; Dowex 50W-X₈ resin; trimethyl orthoformate; In diethyl ether;

DOI:10.1021/jo00174a041

upstream raw materials:

methyl 2-(dimethoxymethyl)benzoate

o-carboxybenzaldehyde

ortho-bromobenzaldehyde

o-bromobenzaldehyde dimethyl acetal

Downstream raw materials:

5,12-naphthacenequinone

1,4-anthraquinone

1-Ethoxy-1,3-dihydroisobenzofuran

Refernces

• 1、 Smith, James G.,Dibble, Peter W.. "2-(Dimethoxymethyl)benzyl Alcohol: A Convenient Isobenzofuran Precursor". . p. 5361 - 5362. Retrieved 2007/10/02.