Scopolin

Base Information

Chemical Name:Scopolin
CAS No.:531-44-2
Molecular Formula:C16H18O9
Molecular Weight:354.314
Hs Code.:
UNII:1Y49270PY8
DSSTox Substance ID:DTXSID20967621
Nikkaji Number:J821.135C
Wikipedia:Scopolin
Wikidata:Q15426984
Pharos Ligand ID:KWHN6BWFDN71
Metabolomics Workbench ID:50363
ChEMBL ID:CHEMBL225024
Mol file:531-44-2.mol

Synonyms:scopolin

Suppliers and Price of Scopolin

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
Scopoletin7-O-Glucoside
10mg
$ 185.00

Medical Isotopes, Inc.
Scopoletin7-O-Glucoside
10 mg
$ 675.00

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

Biosynth Carbosynth
Scopolin
10 mg
$ 125.00

Biosynth Carbosynth
Scopolin
5 mg
$ 80.00

Biosynth Carbosynth
Scopolin
2 mg
$ 50.00

Biosynth Carbosynth
Scopolin
25 mg
$ 200.00

Biosynth Carbosynth
Scopolin
50 mg
$ 325.00

AvaChem
Scopolin
100mg
$ 790.00

AvaChem
Scopolin
5mg
$ 129.00

Total 81 raw suppliers

Chemical Property of Scopolin

Chemical Property:

Vapor Pressure:8.54E-18mmHg at 25°C
Melting Point:217oC
Boiling Point:650.2°Cat760mmHg
PKA:12.71±0.70(Predicted)
Flash Point:241.5°C
PSA：138.82000
Density:1.552g/cm³
LogP:-1.01970
Storage Temp.:2-8°C
XLogP3:-1.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:354.09508215
Heavy Atom Count:25
Complexity:510

Purity/Quality:

≥98% ^*data from raw suppliers

Scopoletin7-O-Glucoside ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C2C(=C1)C=CC(=O)O2)OC3C(C(C(C(O3)CO)O)O)O
Isomeric SMILES:COC1=C(C=C2C(=C1)C=CC(=O)O2)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
Uses Scopoletin 7-O-glucoside is a derivative of Scopoletin (S200500), a common constituent found in a variety of plants that has potential to regulate hyperthyroidism in rats. Scopoletin 7-O-glucoside is a compound that is obtained from the methanolic extract of the fresh underground parts of the flower Scopolia japonica.

Technology Process of Scopolin

There total 2 articles about Scopolin 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: