Isopsoralen
TL;DR: Isopsoralen (CAS 523-50-2) is a chemical compound with molecular formula C11H6O3 and molecular weight 186.0317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
furo[2,3-h]chromen-2-one
Also Known As: Angelicin, ISOPSORALEN, Angecin, 2H-Furo[2,3-H]chromen-2-one, furo[2,3-h]chromen-2-one
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H6O3 |
| Molecular Weight | 186.0317 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 186.0317 Da |
| Heavy Atoms | 14 |
| Complexity | 284.0 |
| Melting Point | 140 °C |
| Boiling Point | 360.00 to 362.00 °C. @ 760.00 mm Hg |
| Vapor Pressure | 0.0000224 [mmHg] |
| Solubility | In water, 20 mg/L |
| SMILES | C1=CC2=C(C=CO2)C3=C1C=CC(=O)O3 |
| InChIKey | XDROKJSWHURZGO-UHFFFAOYSA-N |
Product Description
Applications: Isopsoralen is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopsoralen (CAS 523-50-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Isopsoralen (CAS 523-50-2) is a pharmaceutical intermediate with the molecular formula C11H6O3 and a molecular weight of 186.03 g/mol. Key physical properties include a solubility: In water, 20 mg/L. It is also known as Angelicin and ISOPSORALEN.
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 Isopsoralen
Property Insights of Isopsoralen
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopsoralen. With a topological polar surface area (TPSA) of 39.4 Ų, Isopsoralen exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopsoralen has 0 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 Isopsoralen?
The CAS number of Isopsoralen is 523-50-2.
What is the molecular formula of Isopsoralen?
The molecular formula of Isopsoralen is C11H6O3.
What is the molecular weight of Isopsoralen?
The molecular weight of Isopsoralen is 186.0317 g/mol.
What are the applications of Isopsoralen?
Isopsoralen is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Isopsoralen (CAS 523-50-2) with custom synthesis available from...
Where can I buy Isopsoralen?
You can request a quote for Isopsoralen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isopsoralen?
Yes, CoreyChem provides custom synthesis services for Isopsoralen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.