4-Isocymobarbatol

Base Information

Chemical Name:4-Isocymobarbatol
CAS No.:124962-12-5
Molecular Formula:C₁₆H₂₀Br₂O₂
Molecular Weight:404.142
Hs Code.:
Nikkaji Number:J494.238H
Wikidata:Q104914343
Metabolomics Workbench ID:138378
ChEMBL ID:CHEMBL485051
Mol file:124962-12-5.mol

Synonyms:4-isocymobarbatol;cymobarbatol

Suppliers and Price of 4-Isocymobarbatol

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 2 raw suppliers

Chemical Property of 4-Isocymobarbatol

Chemical Property:

Vapor Pressure:8E-08mmHg at 25°C
Boiling Point:425°Cat760mmHg
Flash Point:210.8°C
PSA：29.46000
Density:1.545g/cm³
LogP:5.04800
XLogP3:5.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:403.98096
Heavy Atom Count:20
Complexity:387

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(CCC2(C1CC3=CC(=C(C=C3O2)Br)O)C)Br)C
Isomeric SMILES:C[C@]12CC[C@@H](C([C@@H]1CC3=CC(=C(C=C3O2)Br)O)(C)C)Br

Technology Process of 4-Isocymobarbatol

There total 1 articles about 4-Isocymobarbatol 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: 97.0%