Sesamol benzoate

Base Information

Chemical Name:Sesamol benzoate
CAS No.:16386-46-2
Molecular Formula:C14H10O4
Molecular Weight:242.2268
Hs Code.:
NSC Number:32510
UNII:40QCA5X22M
DSSTox Substance ID:DTXSID20283616
Wikidata:Q27258349
Mol file:16386-46-2.mol

Synonyms:Sesamol benzoate;1,3-benzodioxol-5-yl benzoate;16386-46-2;NSC-32510;1,3-Benzodioxol-5-ol, benzoate;3,4-Methylenedioxyphenyl benzoate;1,3-Benzodioxol-5-ol, 5-benzoate;3,4-(Methylenedioxy)phenyl benzoate;UNII-40QCA5X22M;40QCA5X22M;Phenol, 3,4-(methylenedioxy)-, benzoate;NSC32510;DTXSID20283616;AO-548/43179433;Q27258349

Suppliers and Price of Sesamol benzoate

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

Total 5 raw suppliers

Chemical Property of Sesamol benzoate

Chemical Property:

Vapor Pressure:8.31E-06mmHg at 25°C
Boiling Point:374.5°Cat760mmHg
Flash Point:167.4°C
PSA：44.76000
Density:1.316g/cm³
LogP:2.63450
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:242.05790880
Heavy Atom Count:18
Complexity:298

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC=C3

Technology Process of Sesamol benzoate

There total 6 articles about Sesamol benzoate 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%

: 533-31-3
Sesamol

: 769-78-8,24991-32-0
vinyl benzoate

: 16386-46-2
benzo[d][1,3]dioxol-5-yl benzoate

Guidance literature:: With 1,4-diaza-bicyclo[2.2.2]octane; In neat (no solvent); at 70 - 140 ℃; for 0.183333h; Microwave irradiation;
DOI:10.1039/c5nj01436k

Reference yield: 52.0%

: 533-31-3
Sesamol

: 591-50-4
iodobenzene

: 50978-45-5
3-oxobenzo[d]isothiazole-2(3H)-carbaldehyde 1,1-dioxide

: 16386-46-2
benzo[d][1,3]dioxol-5-yl benzoate

Guidance literature:: With palladium 10% on activated carbon; sodium carbonate; at 80 ℃; for 18h; Green chemistry;
DOI:10.1039/c6gc03027k

Reference yield: 45.0%

: 533-31-3
Sesamol

: 98-88-4
benzoyl chloride

: 1241783-20-9
(6-hydroxybenzo[d][1,3]dioxol-5-yl)(phenyl)methanone

: 16386-46-2
benzo[d][1,3]dioxol-5-yl benzoate

Guidance literature:: Sesamol; With methyl magnesium iodide; In diethyl ether; at 20 ℃; for 1h; Inert atmosphere;

benzoyl chloride; In toluene; at 0 - 20 ℃; Inert atmosphere;
DOI:10.1002/cbdv.200900263