4,5-Dimethylbenzene-1,2-diol

Base Information

Chemical Name:4,5-Dimethylbenzene-1,2-diol
CAS No.:2785-74-2
Molecular Formula:C8H10O2
Molecular Weight:138.166
Hs Code.:2907299090
DSSTox Substance ID:DTXSID60508315
Nikkaji Number:J116.747B
Wikidata:Q82365130
Mol file:2785-74-2.mol

Synonyms:4,5-dimethylbenzene-1,2-diol;4,5-Dimethylcatechol;2785-74-2;4,5-Dimethyl-1,2-benzenediol;starbld0008720;SCHEMBL69809;DTXSID60508315;VKQJFKLRXDLRNP-UHFFFAOYSA-N;4, 5-dimethylbenzene-1, 2-diol;CAA78574;EN300-1448498

Suppliers and Price of 4,5-Dimethylbenzene-1,2-diol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
4,5-Dimethylcatechol
2.5g
$ 1320.00

Total 5 raw suppliers

Chemical Property of 4,5-Dimethylbenzene-1,2-diol

Chemical Property:

Melting Point:87.5°C
Refractive Index:1.5231 (estimate)
Boiling Point:213.57°C (rough estimate)
PKA:9.93±0.23(Predicted)
PSA：40.46000
Density:1.0742 (rough estimate)
LogP:1.71460
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:138.068079557
Heavy Atom Count:10
Complexity:99.8

Purity/Quality:

99% ^*data from raw suppliers

4,5-Dimethylcatechol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C=C1C)O)O
Uses 4,5-Dimethylcatechol has been used as a reactant in the synthesis of fluorinated catechols.

Technology Process of 4,5-Dimethylbenzene-1,2-diol

There total 21 articles about 4,5-Dimethylbenzene-1,2-diol 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: 95.0%

: 122800-85-5
2-hydroxy-4,4-dimethyl-6-tert-butylcyclohexa-2,5-diene-1-one

: 2785-74-2
4,5-dimethylbenzene-1,2-diol

Guidance literature:: With sulfuric acid; In diethyl ether; for 1h;
DOI:10.1021/jo00086a038

Reference yield: 93.0%

: 1315577-26-4
C₁₆H₂₈O₂Si

: 2785-74-2
4,5-dimethylbenzene-1,2-diol

Guidance literature:: C₁₆H₂₈O₂Si; With palladium(II) trimethylacetate; [bis(acetoxy)iodo]benzene; In toluene; at 100 ℃; Inert atmosphere;

With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 20 ℃;

With water; In tetrahydrofuran;
DOI:10.1021/ja208572v

Reference yield: 88.0%

: 95-65-8
3,4-Dimethylphenol

: 2785-74-2
4,5-dimethylbenzene-1,2-diol

Guidance literature:: With Agaricus bisporus tyrosinase; oxygen; ascorbic acid; In water; at 20 ℃; for 24h; pH=7; Na-phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.bmc.2011.11.018