2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione

Base Information

Chemical Name:2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione
CAS No.:406164-70-3
Molecular Formula:C₁₂H₁₀O₄
Molecular Weight:218.209
Hs Code.:
DSSTox Substance ID:DTXSID601231597
Nikkaji Number:J1.665.057I
Wikidata:Q27139426
Metabolomics Workbench ID:65500
Mol file:406164-70-3.mol

Synonyms:2-hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione;2-hydroxy-3-(2-hydroxyethyl)-1,4-naphthoquinone;406164-70-3;4-hydroxy-3-(2-hydroxyethyl)naphthalene-1,2-dione;CHEBI:71184;DTXSID601231597;2-Hydroxy-3-(2-hydroxyethyl)-1,4-naphthalenedione;Q27139426

Suppliers and Price of 2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione

Supply Marketing:

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

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Chemical Property of 2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione

Chemical Property:

Melting Point:148 - 149 °C (ethyl acetate)
PSA：74.60000
LogP:1.26010
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:218.05790880
Heavy Atom Count:16
Complexity:356

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C2C(=C1)C(=C(C(=O)C2=O)CCO)O

Technology Process of 2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione

There total 2 articles about 2-Hydroxy-3-(2-hydroxyethyl)naphthalene-1,4-dione 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: 48.0%

: 198958-09-7
2-(ethylacetate)-3-hydroxy-1,4-naphthoquinone

: 406164-70-3
2-hydroxy-3-(2-hydroxyethyl)-1,4-naphthoquinone

Guidance literature:: With sodium tetrahydroborate; In methanol; for 7h; Heating;
DOI:10.1016/S0968-0896(03)00226-8

Reference yield:

: 83-72-7
2-hydroxynaphtho-1,4-quinone

: 406164-70-3
2-hydroxy-3-(2-hydroxyethyl)-1,4-naphthoquinone

Guidance literature:: Multi-step reaction with 2 steps

1: 40 percent / lithium carbonate / dimethylformamide / 3 h / Heating

2: 48 percent / NaBH₄ / methanol / 7 h / Heating

With sodium tetrahydroborate; lithium carbonate; In methanol; N,N-dimethyl-formamide;
DOI:10.1016/S0968-0896(03)00226-8