Salicylic acid 2-O-beta-D-glucoside
TL;DR: Salicylic acid 2-O-beta-D-glucoside (CAS 103660-23-7) is a chemical compound with molecular formula C13H16O8 and molecular weight 300.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid
Also Known As: salicylic acid 2-O-beta-D-glucoside, Salicylic acid glucoside, Salicylic acid beta-D-glucoside, Gastrodin Impurity 16, Salicylic acid O-glucoside
| Molecular Formula | C13H16O8 |
|---|---|
| Molecular Weight | 300.08 g/mol |
| LogP | -1.4365 |
| Topological Polar Surface Area | 136.68 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.0845 |
| Heavy Atoms | 21 |
| Complexity | 502.69955 |
Chemical Identifiers
| CAS Number | 103660-23-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
Product Overview
Salicylic acid 2-O-beta-D-glucoside (CAS 103660-23-7), with molecular formula C13H16O8 and molecular weight 300.08 g/mol. IUPAC: 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid.
Chemical Property Profile of Salicylic acid 2-O-beta-D-glucoside
Property Insights of Salicylic acid 2-O-beta-D-glucoside
The XLogP value of -1.4365 indicates that Salicylic acid 2-O-beta-D-glucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Salicylic acid 2-O-beta-D-glucoside. Following Lipinski's Rule of Five, Salicylic acid 2-O-beta-D-glucoside 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 Salicylic acid 2-O-beta-D-glucoside?
The CAS number of Salicylic acid 2-O-beta-D-glucoside is 103660-23-7.
What is the molecular formula of Salicylic acid 2-O-beta-D-glucoside?
The molecular formula of Salicylic acid 2-O-beta-D-glucoside is C13H16O8.
What is the molecular weight of Salicylic acid 2-O-beta-D-glucoside?
The molecular weight of Salicylic acid 2-O-beta-D-glucoside is 300.08 g/mol.
Where can I buy Salicylic acid 2-O-beta-D-glucoside?
You can request a quote for Salicylic acid 2-O-beta-D-glucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Salicylic acid 2-O-beta-D-glucoside?
Yes, KEHONG BIO provides custom synthesis services for Salicylic acid 2-O-beta-D-glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.