3,4,5-Tri-O-galloylquinic acid

Base Information

Chemical Name:3,4,5-Tri-O-galloylquinic acid
CAS No.:99745-62-7
Molecular Formula:C₂₈H₂₄O₁₈
Molecular Weight:648.488
Hs Code.:
NSC Number:692283
DSSTox Substance ID:DTXSID40912512
Nikkaji Number:J552.491A
Wikipedia:3,4,5-Tri-O-galloylquinic_acid
Wikidata:Q10859487,Q105207228
ChEMBL ID:CHEMBL310527
Mol file:99745-62-7.mol

Synonyms:3,4,5-tri-O-galloylquinic acid;TGQA

Suppliers and Price of 3,4,5-Tri-O-galloylquinic 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 21 raw suppliers

Chemical Property of 3,4,5-Tri-O-galloylquinic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:1114.4°Cat760mmHg
Flash Point:364.6°C
PSA：318.50000
Density:1.98g/cm³
LogP:0.62310
XLogP3:1.1
Hydrogen Bond Donor Count:11
Hydrogen Bond Acceptor Count:18
Rotatable Bond Count:10
Exact Mass:648.09626391
Heavy Atom Count:46
Complexity:1040

Purity/Quality:: 99% ,98%,Electron Grade , ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C(C(C(CC1(C(=O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
Isomeric SMILES:C1[C@H](C([C@@H](CC1(C(=O)O)O)OC(=O)C2=CC(=C(C(=C2)O)O)O)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

Technology Process of 3,4,5-Tri-O-galloylquinic acid

There total 2 articles about 3,4,5-Tri-O-galloylquinic 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: 100.0%