4-Hydroxyderricin

Base Information

Chemical Name:4-Hydroxyderricin
CAS No.:55912-03-3
Molecular Formula:C₂₁H₂₂O₄
Molecular Weight:338.403
Hs Code.:
UNII:PF5YY4IV2O
DSSTox Substance ID:DTXSID101316382
Nikkaji Number:J361.087J,J2.788.475J
Metabolomics Workbench ID:26518
ChEMBL ID:CHEMBL458094
Mol file:55912-03-3.mol

Synonyms:4-hydroxyderricin

Suppliers and Price of 4-Hydroxyderricin

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

ChemScene
4-Hydroxyderricin ≥96.0%
5mg
$ 380.00

American Custom Chemicals Corporation
4-HYDROXYDERRICIN 95.00%
5MG
$ 496.34

Total 33 raw suppliers

Chemical Property of 4-Hydroxyderricin

Chemical Property:

Vapor Pressure:2.32E-12mmHg at 25°C
Melting Point:136.0-137.0 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
Boiling Point:542°Cat760mmHg
PKA:7.83±0.40(Predicted)
Flash Point:190.8°C
PSA：66.76000
Density:1.181g/cm³
LogP:4.51120
XLogP3:5.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:338.15180918
Heavy Atom Count:25
Complexity:484

Purity/Quality:

99%, ^*data from raw suppliers

4-Hydroxyderricin ≥96.0% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CCC1=C(C=CC(=C1O)C(=O)C=CC2=CC=C(C=C2)O)OC)C
Isomeric SMILES:CC(=CCC1=C(C=CC(=C1O)C(=O)/C=C/C2=CC=C(C=C2)O)OC)C

Technology Process of 4-Hydroxyderricin

There total 16 articles about 4-Hydroxyderricin 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: 99.0%

: 1092462-94-6
2'-hydroxyl-4'-methoxy-4-methoxymethoxy-3'-prenyl-chalcone

: 54647-08-4,55912-03-3
4-hydroxyderricin

Guidance literature:: With toluene-4-sulfonic acid; In methanol; at 30 ℃; for 24h;
DOI:10.1016/j.tetlet.2008.09.015

Reference yield: 65.0%

: (E)-3-[4-ethoxymethoxyphenyl]-1-[2-hydroxy-4-methoxy-3-(3-methyl-2-butenyl)]prop-2-en-1-one

: 54647-08-4,55912-03-3
4-hydroxyderricin

Guidance literature:: With DOWEX resin; In methanol; at 20 ℃; for 4h;
DOI:10.5012/bkcs.2013.34.9.2815

Reference yield:

: 552-41-0
1-(2-hydroxy-4-methoxyphenyl)ethanone

: 54647-08-4,55912-03-3
4-hydroxyderricin

Guidance literature:: Multi-step reaction with 4 steps

1: potassium carbonate / acetone / 24 h / Reflux

2: sodium hydroxide / ethanol / 12 h / 0 - 20 °C

3: montmorillonite K₁₀ / dichloromethane / 1.5 h / 0 °C

4: toluene-4-sulfonic acid / methanol / 24 h / 30 °C

With potassium carbonate; toluene-4-sulfonic acid; sodium hydroxide; In methanol; ethanol; dichloromethane; acetone; 2: Claisen-Schmidt condensation;
DOI:10.1016/j.tet.2011.04.104