Versicolin
TL;DR: Versicolin (CAS 4389-44-0) is a chemical compound with molecular formula C7H8O3 and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylbenzene-1,2,4-triol
Also Known As: Versicolin, 3-methylbenzene-1,2,4-triol, 2,3,6-Trihydroxytoluene, Toluene-2,3,6-triol, o-Kresoldialkohol
| Molecular Formula | C7H8O3 |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.04735 |
| Heavy Atoms | 10 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 4389-44-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1O)O)O |
| InChIKey | WPFZLGOGWVNEID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Versicolin (CAS 4389-44-0), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: 3-methylbenzene-1,2,4-triol.
Chemical Property Profile of Versicolin
Property Insights of Versicolin
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Versicolin. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Versicolin. Following Lipinski's Rule of Five, Versicolin has 3 hydrogen bond donor(s) and 3 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 Versicolin?
The CAS number of Versicolin is 4389-44-0.
What is the molecular formula of Versicolin?
The molecular formula of Versicolin is C7H8O3.
What is the molecular weight of Versicolin?
The molecular weight of Versicolin is 140.05 g/mol.
Where can I buy Versicolin?
You can request a quote for Versicolin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Versicolin?
Yes, KEHONG BIO provides custom synthesis services for Versicolin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.