2,6-Dimethoxybenzyl alcohol

Base Information

• Chemical Name: 2,6-Dimethoxybenzyl alcohol
• CAS No.: 16700-55-3
• Molecular Formula: C9H12 O3
• Molecular Weight: 168.192
• Hs Code.: 29062990
• European Community (EC) Number: 850-049-4
• DSSTox Substance ID: DTXSID70380265
• Nikkaji Number: J1.548.527B
• Wikidata: Q82170432
• Mol file: 16700-55-3.mol

Synonyms:2,6-DIMETHOXYBENZYL ALCOHOL;(2,6-dimethoxyphenyl)methanol;16700-55-3;MFCD00016862;2,6-dimethoxyphenylmethanol;2,6-Dimethoxylbenzyl alcohol;SCHEMBL505777;DTXSID70380265;(2,6-Dimethoxy-phenyl)-methanol;CHBOWGWPYAAYFF-UHFFFAOYSA-N;HMS1662E05;BBL100281;STL553848;AKOS009157501;AB86586;AM82930;PS-4312;SY064610;CS-0038596;FT-0604596;EN300-104986;F12483;Z397587468

Chemical Property of 2,6-Dimethoxybenzyl alcohol

Chemical Property:

• Vapor Pressure: 0.00297mmHg at 25°C
• Boiling Point: 272.4°Cat760mmHg
• Flash Point: 118.6°C
• PSA: 38.69000
• Density: 1.111g/cm³
• LogP: 1.19610
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 168.078644241
• Heavy Atom Count: 12
• Complexity: 115

Purity/Quality:

98%,99%, ^*data from raw suppliers

(2,6-Dimethoxyphenyl)methanol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=CC=C1)OC)CO

Technology Process of 2,6-Dimethoxybenzyl alcohol

There total 8 articles about 2,6-Dimethoxybenzyl alcohol 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: 94.0%

2,6-dimethoxybenzaldehyde (3392-97-0) → 2,6-dimethoxybenzyl alcohol (16700-55-3)

Guidance literature:

With sodium formate; N-tosylethylenediamine; bis[dichloro(pentamethylcyclopentadienyl)iridium(III)]; at 80 ℃; for 3h;

DOI:10.1002/anie.200602122

Reference yield: 93.0%

2,6-dimethoxybenzaldehyde (3392-97-0) → 6-methoxysalicylaldehyde (700-44-7) + 2,6-dimethoxybenzyl alcohol (16700-55-3) + 2-6-dimethoxybenzoic acid (1466-76-8)

Guidance literature:

2,6-dimethoxybenzaldehyde; With aluminum (III) chloride; In dichloromethane; at -15 - 20 ℃; for 5h; Inert atmosphere; Large scale;

With hydrogenchloride; In dichloromethane; water; at 25 ℃; Inert atmosphere; Large scale;

DOI:10.1021/op049889k

Reference yield: 86.0%

methyl 2,6-dimethoxybenzoate (2065-27-2) → 2,6-dimethoxybenzyl alcohol (16700-55-3)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 20 ℃; for 6h; Inert atmosphere;

DOI:10.1021/acs.orglett.0c01226

upstream raw materials:

2,6-dimethoxybenzaldehyde

2-(2,6-dimethoxy-phenyl)-4,4-dimethyl-4,5-dihydro-oxazole

2-6-dimethoxybenzoic acid

methyl 2,6-dimethoxybenzoate

Downstream raw materials:

2,6-dimethoxytoluene

2,6-dimethoxybenzyl ethyl ether

2-(2,6-dimethoxybenzyloxy)-2-methyl-4H-1,3-benzodioxin-4-one

[2-(2,6-Dimethoxy-benzyloxy)-ethyl]-diethyl-amine

Refernces

• 1、 Mukherjee, Aparajita,Bhattacharya, Samaresh. "Dual utility of a single diphosphine-ruthenium complex: A precursor for new complexes and, a pre-catalyst for transfer-hydrogenation and Oppenauer oxidation". . p. 15617 - 15631. Retrieved 2021/05/19.
• 2、 Aboo, Ahmed H.,Bennett, Elliot L.,Deeprose, Mark,Robertson, Craig M.,Iggo, Jonathan A.,Xiao, Jianliang. "Methanol as hydrogen source: Transfer hydrogenation of aromatic aldehydes with a rhodacycle". supporting information. p. 11805 - 11808. Retrieved 2018/11/10.