HOMOARBUTIN
TL;DR: HOMOARBUTIN (CAS 21082-33-7) is a chemical compound with molecular formula C13H18O7 and molecular weight 286.11 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-(4-hydroxy-3-methylphenoxy)oxane-3,4,5-triol
Also Known As: HOMOARBUTIN, Isohomoarbutin, Orcinol glucoside, HY-N2418, 4-hydroxy-3-methylphenyl hexopyranoside
| Molecular Formula | C13H18O7 |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | -1.12068 |
| Topological Polar Surface Area | 119.61 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.10526 |
| Heavy Atoms | 20 |
| Complexity | 462.03293 |
Chemical Identifiers
| CAS Number | 21082-33-7 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O |
Product Overview
HOMOARBUTIN (CAS 21082-33-7), with molecular formula C13H18O7 and molecular weight 286.11 g/mol. IUPAC: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-hydroxy-3-methylphenoxy)oxane-3,4,5-triol.
Chemical Property Profile of HOMOARBUTIN
Property Insights of HOMOARBUTIN
The XLogP value of -1.12068 indicates that HOMOARBUTIN 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 HOMOARBUTIN. Following Lipinski's Rule of Five, HOMOARBUTIN 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 HOMOARBUTIN?
The CAS number of HOMOARBUTIN is 21082-33-7.
What is the molecular formula of HOMOARBUTIN?
The molecular formula of HOMOARBUTIN is C13H18O7.
What is the molecular weight of HOMOARBUTIN?
The molecular weight of HOMOARBUTIN is 286.11 g/mol.
Where can I buy HOMOARBUTIN?
You can request a quote for HOMOARBUTIN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for HOMOARBUTIN?
Yes, KEHONG BIO provides custom synthesis services for HOMOARBUTIN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.