5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid

Base Information

Chemical Name:5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid
CAS No.:226249-78-1
Molecular Formula:C₁₁H₁₀O₆
Molecular Weight:238.197
Hs Code.:
DSSTox Substance ID:DTXSID901229082
Nikkaji Number:J1.084.233F

Synonyms:DTXSID901229082;226249-78-1;5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid

Suppliers and Price of 5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid

Supply Marketing:

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

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Chemical Property of 5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid

Chemical Property:

XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:238.04773803
Heavy Atom Count:17
Complexity:287

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1COC(O1)C2=CC(=CC(=C2)C(=O)O)C(=O)O

Technology Process of 5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid

There total 4 articles about 5-(1,3-Dioxolan-2-yl)-1,3-benzenedicarboxylic acid 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: 86.0%

: 226249-76-9
5-[1,3]dioxolan-2-yl-isophthalic acid diethyl ester

: 226249-78-1
5-[1,3]dioxolan-2-yl-isophthalic acid

Guidance literature:: With sodium hydroxide; In ethanol;
DOI:10.1016/S0040-4039(99)00330-5

Reference yield:

: 4105-93-5
1,3-bis(ethoxycarbonyl)benzoic acid

: 226249-78-1
5-[1,3]dioxolan-2-yl-isophthalic acid

Guidance literature:: Multi-step reaction with 4 steps

1: 86 percent / Me₂S-BH₃ / tetrahydrofuran

2: 85 percent / MnO₂ / CH₂Cl₂

3: 86 percent / para-toluenesulfonic acid / toluene

4: 86 percent / NaOH / aq. ethanol

With manganese(IV) oxide; sodium hydroxide; dimethylsulfide borane complex; toluene-4-sulfonic acid; In tetrahydrofuran; ethanol; dichloromethane; toluene;
DOI:10.1016/S0040-4039(99)00330-5

Reference yield:

: 181425-91-2
diethyl 5-(hydroxymethyl)isophthalate

: 226249-78-1
5-[1,3]dioxolan-2-yl-isophthalic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 85 percent / MnO₂ / CH₂Cl₂

2: 86 percent / para-toluenesulfonic acid / toluene

3: 86 percent / NaOH / aq. ethanol

With manganese(IV) oxide; sodium hydroxide; toluene-4-sulfonic acid; In ethanol; dichloromethane; toluene;
DOI:10.1016/S0040-4039(99)00330-5