Dodecanoic acid ingenol ester

Base Information

• Chemical Name: Dodecanoic acid ingenol ester
• CAS No.: 54706-70-6
• Molecular Formula: C₃₂H₅₀O₇
• Molecular Weight: 546.745
• Mol file: 54706-70-6.mol

Synonyms:Dodecanoic acid ingenol ester;13-Oxyingenol dodecanoat;13-Oxyingenol Dodecanoate

Chemical Property of Dodecanoic acid ingenol ester

Chemical Property:

• Boiling Point: 655.2±55.0 °C(Predicted)
• PKA: 11.74±0.70(Predicted)
• PSA: 124.29000
• Density: 1.19±0.1 g/cm3 (20 ºC 760 Torr)
• LogP: 4.40190
• Storage Temp.: -20°C Freezer
• Solubility.: Chloroform (Slightly), Methanol (Slightly)

Purity/Quality:

HPLC≥98% ^*data from raw suppliers

13-Oxyingenol Dodecanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 13-Oxyingenol Dodecanoate is a diterpene compound with antinematodal activity. Derivative of Ingenol (I655795), the analogue of Ingenol 3-Angelate (I655800), which has anti-tumor activity when used topically for the treatment of actinic keratosis.

Technology Process of Dodecanoic acid ingenol ester

There total 9 articles about Dodecanoic acid ingenol ester 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%

13-O-dodecanoylingenol 3,4,5,20-diacetonide (184221-52-1) → 13-oxyingenol 13-dodecanoate (54706-70-6)

Guidance literature:

With hydrogenchloride; water; In tetrahydrofuran; at 0 - 20 ℃; for 17h;

DOI:10.1002/anie.201201383

Reference yield:

3-O-(2.3-dimethylbutyryl)-13-O-n-dodecanoyl-13-hydroxyingenol (76663-53-1) → 13-oxyingenol 13-dodecanoate (54706-70-6)

Guidance literature:

With methanol; potassium hydroxide; at 20 ℃; for 3h;

Reference yield:

C36H54O9 → 13-oxyingenol 13-dodecanoate (54706-70-6)

Guidance literature:

With sodium hydroxide; In methanol; at 20 ℃; for 2h;

DOI:10.1055/a-0646-4306

upstream raw materials:

C₃₈H₆₀O₆SeSi₂

C₃₂H₅₆O₆Si₂

C₂₆H₃₆O₆

13-O-dodecanoylingenol 3,4,5,20-diacetonide