Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate

Base Information

Chemical Name:Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate
CAS No.:87568-18-1
Molecular Formula:C9H9ClO4
Molecular Weight:216.621
Hs Code.:
DSSTox Substance ID:DTXSID80519564
Wikidata:Q82382845

Synonyms:Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate;87568-18-1;DTXSID80519564

Suppliers and Price of Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate

Supply Marketing:

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

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Chemical Property of Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:216.0189365
Heavy Atom Count:14
Complexity:221

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C(=C1Cl)C(=O)OC)O)O

Technology Process of Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate

There total 4 articles about Methyl 2-chloro-5,6-dihydroxy-3-methylbenzoate 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: 60.0%

: 87567-89-3
3-methyl-5,6-dioxo-1,3-cyclohexadienecarboxylic acid methyl ester

: 87568-18-1
6-chloro-2,3-dihydroxy-5-methylbenzoic acid methyl ester

Guidance literature:: With hydrogenchloride; In isopropyl alcohol; benzene; for 0.0833333h;
DOI:10.1021/jo00173a018

Reference yield:

: 17746-75-7
3-bromo-5-methylsalicylic acid

: 87568-18-1
6-chloro-2,3-dihydroxy-5-methylbenzoic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) NaOH, CuSO₄, 2.) HCl / H₂O / 1.) reflux, 6 h

2: 75 percent / BF₃*Et₂O / 4 h / Heating

3: 85 percent / Ag₂O, Na₂SO₄ / diethyl ether / 0.33 h

4: 60 percent / HCl / benzene; propan-2-ol / 0.08 h

With hydrogenchloride; sodium hydroxide; boron trifluoride diethyl etherate; copper(II) sulfate; sodium sulfate; silver(l) oxide; In diethyl ether; water; isopropyl alcohol; benzene;
DOI:10.1021/jo00173a018

Reference yield:

: 6049-93-0
2,3-dihydroxy-5-methylbenzoic acid

: 87568-18-1
6-chloro-2,3-dihydroxy-5-methylbenzoic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 75 percent / BF₃*Et₂O / 4 h / Heating

2: 85 percent / Ag₂O, Na₂SO₄ / diethyl ether / 0.33 h

3: 60 percent / HCl / benzene; propan-2-ol / 0.08 h

With hydrogenchloride; boron trifluoride diethyl etherate; sodium sulfate; silver(l) oxide; In diethyl ether; isopropyl alcohol; benzene;
DOI:10.1021/jo00173a018