Microphyllinic acid

Base Information

Chemical Name:Microphyllinic acid
CAS No.:491-46-3
Molecular Formula:C29H36O9
Molecular Weight:528.59
Hs Code.:
DSSTox Substance ID:DTXSID601122564
Nikkaji Number:J11.764A
Wikidata:Q105385981
Mol file:491-46-3.mol

Synonyms:491-46-3;Microphyllinic acid;Microphyllinsaure;DTXSID601122564;2-Hydroxy-4-[[2-hydroxy-4-methoxy-6-(2-oxoheptyl)benzoyl]oxy]-6-(2-oxoheptyl)benzoic acid

Suppliers and Price of Microphyllinic acid

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 1 raw suppliers

Chemical Property of Microphyllinic acid

Chemical Property:

PSA：147.43000
LogP:5.40760
XLogP3:6.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:17
Exact Mass:528.23593272
Heavy Atom Count:38
Complexity:782

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(=O)CC1=C(C(=CC(=C1)OC)O)C(=O)OC2=CC(=C(C(=C2)O)C(=O)O)CC(=O)CCCCC

Technology Process of Microphyllinic acid

There total 5 articles about Microphyllinic acid 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: 92.0%

: 112642-51-0
benzyl microphyllinate

: 491-46-3
2-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxo-heptyl)-benzoyloxy]-6-(2-oxo-heptyl)-benzoic acid

Guidance literature:: With hydrogen; palladium on activated charcoal; In ethyl acetate; for 3h;

Reference yield:

: 112642-52-1
benzyl 2,4-dihydroxy-6-(2-oxoheptyl)benzoate

: 491-46-3
2-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxo-heptyl)-benzoyloxy]-6-(2-oxo-heptyl)-benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 62 percent / dicyclohexylcarbodiimide / toluene / 4 h / Ambient temperature

2: 77 percent / 5 M HCl / methanol / Ambient temperature

3: 88 percent / hydrogen / 10percent palladium on carbon / ethyl acetate / 16 h

With hydrogenchloride; hydrogen; dicyclohexyl-carbodiimide; palladium on activated charcoal; In methanol; ethyl acetate; toluene;
DOI:10.1071/C96173

Reference yield:

: 176447-87-3
2-Hydroxy-4-methoxy-6-(2-pentyl-[1,3]dioxolan-2-ylmethyl)-benzoic acid

: 491-46-3
2-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxo-heptyl)-benzoyloxy]-6-(2-oxo-heptyl)-benzoic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 62 percent / dicyclohexylcarbodiimide / toluene / 4 h / Ambient temperature

2: 77 percent / 5 M HCl / methanol / Ambient temperature

3: 88 percent / hydrogen / 10percent palladium on carbon / ethyl acetate / 16 h

With hydrogenchloride; hydrogen; dicyclohexyl-carbodiimide; palladium on activated charcoal; In methanol; ethyl acetate; toluene;
DOI:10.1071/C96173