(2,4,5-Trimethoxyphenyl)methanol

Base Information

• Chemical Name: (2,4,5-Trimethoxyphenyl)methanol
• CAS No.: 30038-31-4
• Molecular Formula: C10H14O4
• Molecular Weight: 198.219
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID20357583
• Nikkaji Number: J1.625.812A
• Wikidata: Q82137543
• Mol file: 30038-31-4.mol

Synonyms:(2,4,5-trimethoxyphenyl)methanol;30038-31-4;2,4,5-Trimethoxybenzyl alcohol;Benzenemethanol, 2,4,5-trimethoxy-;SCHEMBL95746;2,4,5-trimethoxylbenzyl alcohol;DTXSID20357583;HMS1788F01;AMY41739;MFCD00021966;AKOS000120165;SB85145;2,4,5-Trimethoxybenzyl alcohol, 97%;LS-04527;BB 0259532;CS-0204436;FT-0683887;EN300-18753;E89208;A820153;J-017744;Z90122579;InChI=1/C10H14O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-5,11H,6H2,1-3H

Chemical Property of (2,4,5-Trimethoxyphenyl)methanol

Chemical Property:

• Vapor Pressure: 0.000134mmHg at 25°C
• Melting Point: 70-72oC(lit.)
• Boiling Point: 320.2oC at 760 mmHg
• Flash Point: 147.4oC
• PSA: 47.92000
• Density: 1.131g/cm3
• LogP: 1.20470
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 198.08920892
• Heavy Atom Count: 14
• Complexity: 162

Purity/Quality:

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

(2,4,5-Trimethoxyphenyl)methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1CO)OC)OC

Technology Process of (2,4,5-Trimethoxyphenyl)methanol

There total 4 articles about (2,4,5-Trimethoxyphenyl)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: 97.0%

asaraldehyde (4460-86-0,14374-62-0) → (2,4,5-trimethoxyphenyl)methanol (30038-31-4)

Guidance literature:

With methanol; sodium tetrahydroborate; at 0 - 20 ℃; for 18h; Inert atmosphere; Schlenk technique;

DOI:10.1002/anie.201609598

Reference yield: 71.0%

asaronic acid (490-64-2) → (2,4,5-trimethoxyphenyl)methanol (30038-31-4)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 0 - 20 ℃; for 1.5h; Time; Inert atmosphere;

DOI:10.1021/ol5014119

Reference yield:

methyl 2,4,5-trimethoxybenzoate (20029-76-9) → (2,4,5-trimethoxyphenyl)methanol (30038-31-4)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether;

DOI:10.1016/S0960-894X(02)00291-3

upstream raw materials:

asaraldehyde

methyl 2,4,5-trimethoxybenzoate

asaronic acid

1,2,4-trimethoxy-benzene

Refernces

• 1、 Takaya, Yoshiaki,Hotta, Rie,Fujiwara, Kenshu,Otani, Risa,Uchiyama, Yurika,Sakakibara, Mizuki,Fukuda, Eri,Niwa, Masatake,Inouye, Kei,Oohata, Akiko A.. "Alkylbenzoquinone involved in development of cellular slime molds". supporting information. p. 3660 - 3663. Retrieved 2014/08/05.
• 2、 Witiak,Loper,Ananthan,Almerico,Verhoef,Filppi. "Mono and bis(bioreductive) alkylating agents: Synthesis and antitumor activities in a B16 melanoma model". . p. 1636 - 1642. Retrieved 2007/10/02.