Heptyl glucoside
TL;DR: Heptyl glucoside (CAS 128052-80-2) is a chemical compound with molecular formula C13H26O6 and molecular weight 278.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-heptoxy-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: heptyl glucoside, Heptyl beta-D-glucopyranoside, HEPTYL-BETA-D-GLUCOPYRANOSIDE, Heptyl D-glucoside, n-Heptyl beta-D-glucopyranoside
| Molecular Formula | C13H26O6 |
|---|---|
| Molecular Weight | 278.17 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.17294 |
| Heavy Atoms | 19 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 128052-80-2 |
|---|---|
| SMILES | CCCCCCCO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| InChIKey | NIDYWHLDTIVRJT-UJPOAAIJSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptyl glucoside (CAS 128052-80-2), with molecular formula C13H26O6 and molecular weight 278.17 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-heptoxy-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of Heptyl glucoside
Property Insights of Heptyl glucoside
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptyl glucoside. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Heptyl glucoside. Following Lipinski's Rule of Five, Heptyl glucoside has 4 hydrogen bond donor(s) and 6 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 Heptyl glucoside?
The CAS number of Heptyl glucoside is 128052-80-2.
What is the molecular formula of Heptyl glucoside?
The molecular formula of Heptyl glucoside is C13H26O6.
What is the molecular weight of Heptyl glucoside?
The molecular weight of Heptyl glucoside is 278.17 g/mol.
Where can I buy Heptyl glucoside?
You can request a quote for Heptyl glucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl glucoside?
Yes, KEHONG BIO provides custom synthesis services for Heptyl glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.