4-[(12-Hydroxydodecyl)oxy]benzoic acid

Base Information

Chemical Name:4-[(12-Hydroxydodecyl)oxy]benzoic acid
CAS No.:112231-71-7
Molecular Formula:C19H30O4
Molecular Weight:322.445
Hs Code.:
DSSTox Substance ID:DTXSID001282223
Nikkaji Number:J2.817.621J

Synonyms:SCHEMBL4653588;DTXSID001282223;4-[(12-Hydroxydodecyl)oxy]benzoic acid;112231-71-7

Suppliers and Price of 4-[(12-Hydroxydodecyl)oxy]benzoic acid

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

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Chemical Property of 4-[(12-Hydroxydodecyl)oxy]benzoic acid

Chemical Property:

XLogP3:5.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:14
Exact Mass:322.21440943
Heavy Atom Count:23
Complexity:285

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C(=O)O)OCCCCCCCCCCCCO

Technology Process of 4-[(12-Hydroxydodecyl)oxy]benzoic acid

There total 3 articles about 4-[(12-Hydroxydodecyl)oxy]benzoic 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: 95.0%

: 59100-01-5
methyl 4-((12-hydroxydodecyl)oxy)benzoate

: 112231-71-7
4-((12-hydroxydodecyl)oxy)benzoic acid

Guidance literature:: methyl 4-((12-hydroxydodecyl)oxy)benzoate; With potassium hydroxide; In ethanol; for 16h; Reflux;

With hydrogenchloride; In ethanol; water; for 0.5h;
DOI:10.1021/ma901960c

Reference yield:

: 5675-51-4
1,12-dodecandiol

: 112231-71-7
4-((12-hydroxydodecyl)oxy)benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: hydrogen bromide / toluene / 24 h / 60 °C

2.1: potassium carbonate / acetone / 20 h / Reflux

3.1: potassium hydroxide / ethanol / 16 h / Reflux

3.2: 0.5 h

With hydrogen bromide; potassium carbonate; potassium hydroxide; In ethanol; acetone; toluene;
DOI:10.1021/ma901960c

Reference yield:

: 3344-77-2
12-bromododecanol

: 112231-71-7
4-((12-hydroxydodecyl)oxy)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / acetone / 20 h / Reflux

2.1: potassium hydroxide / ethanol / 16 h / Reflux

2.2: 0.5 h

With potassium carbonate; potassium hydroxide; In ethanol; acetone;
DOI:10.1021/ma901960c