Pyrocatechol-O-Beta-D-Glucopyranoside
TL;DR: Pyrocatechol-O-Beta-D-Glucopyranoside (CAS 2400-71-7) is a chemical compound with molecular formula C12H16O7 and molecular weight 272.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(2-hydroxyphenoxy)oxane-3,4,5-triol
Also Known As: Pyrocatechol monoglucoside, Eicosanaldehyde, Pyrocatecholmonoglucoside, o-Hydroxyphenyl -D-glucoside, 2-Hydroxyphenyl D-glucopyranoside
| Molecular Formula | C12H16O7 |
|---|---|
| Molecular Weight | 272.09 g/mol |
| LogP | -1.4291 |
| Topological Polar Surface Area | 119.61 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.0896 |
| Heavy Atoms | 19 |
| Complexity | 422.29385 |
Chemical Identifiers
| CAS Number | 2400-71-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
Product Overview
Pyrocatechol-O-Beta-D-Glucopyranoside (CAS 2400-71-7), with molecular formula C12H16O7 and molecular weight 272.09 g/mol. IUPAC: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(2-hydroxyphenoxy)oxane-3,4,5-triol.
Chemical Property Profile of Pyrocatechol-O-Beta-D-Glucopyranoside
Property Insights of Pyrocatechol-O-Beta-D-Glucopyranoside
The XLogP value of -1.4291 indicates that Pyrocatechol-O-Beta-D-Glucopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyrocatechol-O-Beta-D-Glucopyranoside. Following Lipinski's Rule of Five, Pyrocatechol-O-Beta-D-Glucopyranoside has 5 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrocatechol-O-Beta-D-Glucopyranoside?
The CAS number of Pyrocatechol-O-Beta-D-Glucopyranoside is 2400-71-7.
What is the molecular formula of Pyrocatechol-O-Beta-D-Glucopyranoside?
The molecular formula of Pyrocatechol-O-Beta-D-Glucopyranoside is C12H16O7.
What is the molecular weight of Pyrocatechol-O-Beta-D-Glucopyranoside?
The molecular weight of Pyrocatechol-O-Beta-D-Glucopyranoside is 272.09 g/mol.
Where can I buy Pyrocatechol-O-Beta-D-Glucopyranoside?
You can request a quote for Pyrocatechol-O-Beta-D-Glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrocatechol-O-Beta-D-Glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Pyrocatechol-O-Beta-D-Glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.