3-Methylanthralin
TL;DR: 3-Methylanthralin (CAS 491-59-8) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methylanthracene-1,8,9-triol
Also Known As: CHRYSAROBIN, 3-Methylanthralin, Purified araroba, 3-Methyl-1,8,9-anthracenetriol, Chrysophanic acid anthranol
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H12O3 |
| Molecular Weight | 240.07864 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 240.07864 Da |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
| SMILES | CC1=CC2=C(C(=C1)O)C(=C3C(=C2)C=CC=C3O)O |
| InChIKey | JBGKVNQFVAJOGC-UHFFFAOYSA-N |
Product Description
Applications: 3-Methylanthralin is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
3-Methylanthralin is a pharmaceutical intermediate identified by CAS number 491-59-8 and the molecular formula C15H12O3 and a molecular weight of 240.08 g/mol. Synonyms include CHRYSAROBIN and 3-Methylanthralin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3-Methylanthralin
Property Insights of 3-Methylanthralin
The XLogP value of 4.3 indicates that 3-Methylanthralin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methylanthralin. Following Lipinski's Rule of Five, 3-Methylanthralin 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
What is the CAS number of 3-Methylanthralin?
The CAS number of 3-Methylanthralin is 491-59-8.
What is the molecular formula of 3-Methylanthralin?
The molecular formula of 3-Methylanthralin is C15H12O3.
What is the molecular weight of 3-Methylanthralin?
The molecular weight of 3-Methylanthralin is 240.07864 g/mol.
What are the applications of 3-Methylanthralin?
3-Methylanthralin is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS,...
Where can I buy 3-Methylanthralin?
You can request a quote for 3-Methylanthralin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methylanthralin?
Yes, CoreyChem provides custom synthesis services for 3-Methylanthralin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.