Benzoyl-beta-D-glucoside

Base Information

Chemical Name:Benzoyl-beta-D-glucoside
CAS No.:21056-52-0
Molecular Formula:C13H16O7
Molecular Weight:284.266
Hs Code.:
UNII:U2X7G335QH
DSSTox Substance ID:DTXSID40943366
Nikkaji Number:J254.139D
Wikidata:Q4890806
Wikipedia:Benzoyl-beta-D-glucoside
Mol file:21056-52-0.mol

Synonyms:periplanetin;Benzoyl-beta-D-glucoside;Benzoyl beta-D-glucopyranoside;21056-52-0;benzoyl-beta-D-glucopyranose;(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl benzoate;NSC-231872;benzoyl-beta-glucoside;Benzoyl |A-D-glucopyranoside;benzoate beta-D-glucose ester;phenylformic acid glucose ester;U2X7G335QH;SCHEMBL10524702;beta-D-glucopyranose, 1-benzoate;DTXSID40943366;1-O-Benzoyl-beta-D-glucopyranose;CHEBI:141410;benzoic acid beta-D- glucose ester;BENZOYL .BETA.-D-GLUCOSIDE;AKOS040762851;HY-W415953;.BETA.-D-GLUCOPYRANOSYL BENZOATE;NCGC00385680-01;benzenecarboxylic acid beta-D-glucose ester;CS-0535859;NS00066846;Q4890806;BENZOIC ACID 1-O-.BETA.-D-GLUCOPYRANOSYL ESTER;NCGC00385680-01_C13H16O7_1-O-Benzoyl-beta-D-glucopyranose;[(2S, 3R, 4S, 5S, 6R)-3, 4, 5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] benzoate;[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] benzoate

Suppliers and Price of Benzoyl-beta-D-glucoside

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 10 raw suppliers

Chemical Property of Benzoyl-beta-D-glucoside

Chemical Property:

Vapor Pressure:4.19E-11mmHg at 25°C
Melting Point:193 °C
Boiling Point:507.1°C at 760 mmHg
PKA:12?+-.0.70(Predicted)
Flash Point:194.1°C
PSA：116.45000
Density:1.5g/cm³
LogP:-1.35670
XLogP3:-1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:284.08960285
Heavy Atom Count:20
Complexity:329

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)OC2C(C(C(C(O2)CO)O)O)O
Isomeric SMILES:C1=CC=C(C=C1)C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O

Technology Process of Benzoyl-beta-D-glucoside

There total 18 articles about Benzoyl-beta-D-glucoside 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: 91.0%

: 63053-84-9
1-O-benzoyl-2,3,4,6-tetra-O-benzyl-β-D-glucopyranose

: 21056-52-0
Benzoic acid (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl ester

Guidance literature:: With hydrogen; palladium on activated charcoal; In ethanol; ethyl acetate; under 757.6 Torr;

Reference yield: 66.0%

: 492-62-6
alpha-D-glucopyranose

: 65-85-0,8013-63-6
benzoic acid

: 21056-52-0
Benzoic acid (2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl ester

Guidance literature:: With di-isopropyl azodicarboxylate; triphenylphosphine; In 1,4-dioxane; for 0.5h; Solvent; stereoselective reaction; Inert atmosphere; Irradiation;
DOI:10.1021/acs.orglett.0c01549