Estradiol monopalmitate

Base Information

Chemical Name:Estradiol monopalmitate
CAS No.:5776-45-4
Molecular Formula:C34H54 O3
Molecular Weight:510.801
Hs Code.:
European Community (EC) Number:227-300-6
UNII:1Q5Y448XT0
DSSTox Substance ID:DTXSID00973346
Nikkaji Number:J218.041C
Wikipedia:Estradiol_palmitate
Wikidata:Q24884528
NCI Thesaurus Code:C76110
Mol file:5776-45-4.mol

Synonyms:estradiol 17-palmitate;estradiol-17beta-palmitate

Suppliers and Price of Estradiol monopalmitate

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

TRC
Estradiol17-Palmitate
100mg
$ 140.00

Total 5 raw suppliers

Chemical Property of Estradiol monopalmitate

Chemical Property:

Boiling Point:608.9°Cat760mmHg
Flash Point:222.1°C
PSA：46.53000
Density:1.03g/cm³
LogP:9.64140
XLogP3:11.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:16
Exact Mass:510.40729558
Heavy Atom Count:37
Complexity:676

Purity/Quality:

99% ^*data from raw suppliers

Estradiol17-Palmitate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)O)C
Isomeric SMILES:CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C
Uses Estradiol 17-Palmitate is a metabolite of estradiol (E888000) which is the major estrogen secreted by the premenopausal ovary.

Technology Process of Estradiol monopalmitate

There total 2 articles about Estradiol monopalmitate 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:

: 63042-27-3
3.17β-dipalmitoyloxy-estratriene-(1.3.5(10))

: 5776-45-4
estradiol 17β-monopalmitate

Guidance literature:: With 1-butyl-3-methylimidazolium chloride; potassium hydroxide; In pyridine; toluene; at 80 ℃; for 0.0166667h; regioselective reaction; Microwave irradiation;
DOI:10.1016/j.steroids.2010.03.005

Reference yield:

: 50-28-2
estradiol

: 112-67-4
n-hexadecanoyl chloride

: 5776-45-4
estradiol 17β-monopalmitate

Guidance literature:: With pyridine; sodium hydrogencarbonate; Yield given. Multistep reaction; 1.) 12 h, r.t., 2.) C₆H₆, CH₃OH, 50-55 deg C;
DOI:10.1002/oms.1210270612