Pinusolide

Base Information

Chemical Name:Pinusolide
CAS No.:31685-80-0
Molecular Formula:C₂₁H₃₀O₄
Molecular Weight:346.467
Hs Code.:
DSSTox Substance ID:DTXSID90953637
Nikkaji Number:J17.758J
Wikidata:Q27137577
ChEMBL ID:CHEMBL425068
Mol file:31685-80-0.mol

Synonyms:pinusolide

Suppliers and Price of Pinusolide

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

DC Chemicals
Pinusolide >98%,StandardReferencesGrade
20 mg
$ 280.00

Crysdot
Pinusolide 95+%
5mg
$ 730.00

Biorbyt Ltd
Pinusolide >98%,Standard References Grade
20 mg
$ 569.50

Arctom
Pinusolide ≥98%
5mg
$ 463.00

Arctom
Pinusolide
5mg
$ 136.00

American Custom Chemicals Corporation
PINUSOLIDE 95.00%
5MG
$ 495.42

Total 22 raw suppliers

Chemical Property of Pinusolide

Chemical Property:

Vapor Pressure:7.76E-09mmHg at 25°C
Melting Point:82-84 °C(Solv: ligroine (8032-32-4))
Boiling Point:465.3°Cat760mmHg
Flash Point:228.5°C
PSA：52.60000
Density:1.1g/cm³
LogP:4.20170
XLogP3:4.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:346.21440943
Heavy Atom Count:25
Complexity:619

Purity/Quality:

97% ^*data from raw suppliers

Pinusolide >98%,StandardReferencesGrade ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCCC(C1CCC(=C)C2CCC3=CCOC3=O)(C)C(=O)OC
Isomeric SMILES:C[C@]12CCC[C@]([C@@H]1CCC(=C)[C@@H]2CCC3=CCOC3=O)(C)C(=O)OC

Technology Process of Pinusolide

There total 6 articles about Pinusolide 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: 67.0%

: 909297-15-0
methyl 5-[2-(2,5-dimethoxy-2,5-dihydrofuran-3-yl)ethyl]-1,4a-dimethyl-6-methylidene-decahydronaphthalene-1-carboxylate

: 31685-80-0
Pinusolide

Guidance literature:: With hydrogenchloride; In 1,4-dioxane; for 0.5h;
DOI:10.1134/S1070428006060030

Reference yield:

: 67-56-1
methanol

: 1238-98-8,2222-52-8,4966-14-7,10267-15-9
lambertianic acid methyl ester

: 31685-80-0
Pinusolide

Guidance literature:: methanol; lambertianic acid methyl ester; With chloramine-B; acetic acid; at 5 ℃; for 0.5h;

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 0.5h;
DOI:10.1016/j.bmcl.2006.05.077

Reference yield:

: 1235-76-3,1235-77-4,4966-13-6,10267-14-8
lambertiainic acid

: 31685-80-0
Pinusolide

Guidance literature:: Multi-step reaction with 2 steps

1.1: 96 percent / diethyl ether / 2 h / 20 °C

2.1: N-chlorobenzenesulfonamide sodium salt; acetic acid / 0.5 h / 5 °C

2.2: 1.18 g / aq. HCl / dioxane / 0.5 h / 20 °C

With chloramine-B; acetic acid; In diethyl ether;
DOI:10.1016/j.bmcl.2006.05.077