4-(Hydroxymethyl)-1,3-benzenediol

Base Information

• Chemical Name: 4-(Hydroxymethyl)-1,3-benzenediol
• CAS No.: 33617-59-3
• Molecular Formula: C7H8 O3
• Molecular Weight: 140.139
• Hs Code.: 2907299090
• European Community (EC) Number: 251-597-1
• UNII: 2F45WP9BJE
• DSSTox Substance ID: DTXSID4067777
• Nikkaji Number: J28.481E
• Wikidata: Q81994425
• Mol file: 33617-59-3.mol

Synonyms:2,4-Dihydroxybenzyl alcohol;33617-59-3;4-(hydroxymethyl)benzene-1,3-diol;4-(Hydroxymethyl)-1,3-benzenediol;4-(Hydroxymethyl)resorcinol;1,3-Benzenediol, 4-(hydroxymethyl)-;2F45WP9BJE;EINECS 251-597-1;2,4-Dihydroxybenzylalcohol;4-methylol resorcinol;UNII-2F45WP9BJE;4-METHYLOLRESORCINOL;SCHEMBL647503;DTXSID4067777;Benzyl alcohol, 2,4-dihydroxy-;AKOS000249269;CS-0378161;FT-0712838;A18664;EN300-1263449

Chemical Property of 4-(Hydroxymethyl)-1,3-benzenediol

Chemical Property:

• Vapor Pressure: 6.43E-06mmHg at 25°C
• Boiling Point: 363.4°Cat760mmHg
• PKA: 9.53±0.18(Predicted)
• Flash Point: 190.6°C
• PSA: 60.69000
• Density: 1.399g/cm³
• LogP: 0.59010
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 140.047344113
• Heavy Atom Count: 10
• Complexity: 105

Purity/Quality:

99%, ^*data from raw suppliers

2,4-Dihydroxybenzyl alcohol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1O)O)CO

Technology Process of 4-(Hydroxymethyl)-1,3-benzenediol

There total 5 articles about 4-(Hydroxymethyl)-1,3-benzenediol 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:

2,4-Dihydroxybenzaldehyde (95-01-2) → 1,3-dihydroxy-4-dihydroxymethyl benzene (33617-59-3)

Guidance literature:

With hydrogen; In ethanol; at 100 ℃; for 4h; under 11251.1 Torr; Autoclave;

DOI:10.1016/j.mcat.2020.111149

Reference yield:

4-hydroxysalicylic acid (89-86-1) → 1,3-dihydroxy-4-dihydroxymethyl benzene (33617-59-3)

Guidance literature:

With sodium tetrahydroborate; In tetrahydrofuran; at 20 ℃;

Reference yield:

2,4-dibenzyloxybenzyl alcohol (33617-58-2) → 1,3-dihydroxy-4-dihydroxymethyl benzene (33617-59-3)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol;

upstream raw materials:

formaldehyd

recorcinol

2,4-dibenzyloxybenzyl alcohol

2,4-dibenzyloxybenzaldehyde

Downstream raw materials:

2,4-dihydroxybenzamide

2,4-dihydroxy-5-chlorobenzaldehyde

4-hydroxysalicylic acid

Refernces

• 1、 Hu, Ao,Lu, Xinhuan,Pan, Haijun,Wang, Chenlong,Xia, Qinghua,Xia, Yongde,Yang, Lu,Yue, Fanfan,Zhang, Haifu,Zhou, Dan. "Mild-temperature hydrogenation of carbonyls over Co-ZIF-9 derived Co-ZIF-x nanoparticle catalyst". . . Retrieved 2020/08/21.
• 2、 Lamartine, Roger,Perrin, Robert,Vicens, Jacques,Gamet, Daniel,Perrin, Monique,et al.. "SOLID STATE POLYCONDENSATION OF PRECURSORS OF PHENOLIC RESINS". . p. 219 - 236. Retrieved 2007/10/02.