4-Hydroxy cinnamyl alcohol diacetate

Base Information

Chemical Name:4-Hydroxy cinnamyl alcohol diacetate
CAS No.:113944-48-2
Molecular Formula:C13H14O4
Molecular Weight:234.252
Hs Code.:
Nikkaji Number:J870.437F,J914.395E
Wikidata:Q27159250
Metabolomics Workbench ID:70806
ChEMBL ID:CHEMBL444328
Mol file:113944-48-2.mol

Synonyms:4-hydroxy cinnamyl alcohol diacetate;trans-p-Coumaryl diacetate;113944-48-2;Coumaryl alcohol acetate;bmse010149;(E)-3-(4-Acetoxyphenyl)allyl acetate;CHEMBL444328;CHEBI:86565;[(E)-3-(4-acetoxyphenyl)allyl] acetate;Phenol, 4-[(1E)-3-(acetyloxy)-1-propen-1-yl]-, 1-acetate;(2E)-3-[4-(acetyloxy)phenyl]prop-2-en-1-yl acetate;4-acetoxy cinnamyl acetate;[(E)-3-(4-acetyloxyphenyl)prop-2-enyl] Acetate;E-p-coumaryl alcohol diacetate;SCHEMBL13568130;JAFORXKRQBIDEE-ONEGZZNKSA-N;AC9444;(E)-4-Acetoxycinnamyl alcohol acetate;Acetic acid 3-(4-acetoxyphenyl)-2-propenyl ester;Q27159250;Phenol, 4-[(1E)-3-(acetyloxy)-1-propenyl]-, acetate;Phenol, 4-[3-(acetyloxy)-1-propenyl]-, acetate, (E)-

Suppliers and Price of 4-Hydroxy cinnamyl alcohol diacetate

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
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price

Total 1 raw suppliers

Chemical Property of 4-Hydroxy cinnamyl alcohol diacetate

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:234.08920892
Heavy Atom Count:17
Complexity:288

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)OCC=CC1=CC=C(C=C1)OC(=O)C
Isomeric SMILES:CC(=O)OC/C=C/C1=CC=C(C=C1)OC(=O)C

Technology Process of 4-Hydroxy cinnamyl alcohol diacetate

There total 3 articles about 4-Hydroxy cinnamyl alcohol diacetate 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%

: 52946-22-2,108147-21-3,53890-21-4
1-acetoxychavicol acetate

: 113944-48-2
(E)-3-(4-acetoxyphenyl)-2-propenyl acetate

Guidance literature:: With sodium acetate; acetic acid; at 60 ℃;
DOI:10.1016/j.bmc.2005.10.029

Reference yield:

: 108-24-7
acetic anhydride

: Acetic acid 3-(4-acetoxy-phenyl)-3-bromo-2-(2-methoxy-phenoxy)-propyl ester

: 113944-48-2
(E)-3-(4-acetoxyphenyl)-2-propenyl acetate

: trans-p-coumaryl diacetate

Guidance literature:: With pyridine; In dichloromethane; for 0.666667h; Title compound not separated from byproducts;
DOI:10.1021/jf970539p

Reference yield:

: 52946-22-2,108147-21-3,53890-21-4
1-acetoxychavicol acetate

: 113944-48-2
(E)-3-(4-acetoxyphenyl)-2-propenyl acetate

: 94723-93-0
acetic acid (E)-4-(3-hydroxypropenyl)phenyl ester

: (1'R,S)-1'-hydroxychavicol acetate

Guidance literature:: In water; for 2h; Further Variations:; Temperatures; Solvents; pH-values; time; Product distribution; Heating;
DOI:10.1021/jf9808224