4-Phenylcoumarin
TL;DR: 4-Phenylcoumarin (CAS 15185-05-4) is a chemical compound with molecular formula C15H10O2 and molecular weight 222.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-phenylchromen-2-one
Also Known As: 4-Phenylcoumarin, phenylcoumarin, 4-phenylchromen-2-one, 4-Phenyl-2H-chromen-2-one, 4-phenylcoumarine
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H10O2 |
| Molecular Weight | 222.06808 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.06808 Da |
| Heavy Atoms | 17 |
| Complexity | 326.0 |
| SMILES | C1=CC=C(C=C1)C2=CC(=O)OC3=CC=CC=C32 |
| InChIKey | SAZHWFFOFMSQPA-UHFFFAOYSA-N |
Chemical Property Profile of 4-Phenylcoumarin
Property Insights of 4-Phenylcoumarin
The XLogP value of 3.1 indicates that 4-Phenylcoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 4-Phenylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Phenylcoumarin has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Phenylcoumarin?
The CAS number of 4-Phenylcoumarin is 15185-05-4.
What is the molecular formula of 4-Phenylcoumarin?
The molecular formula of 4-Phenylcoumarin is C15H10O2.
What is the molecular weight of 4-Phenylcoumarin?
The molecular weight of 4-Phenylcoumarin is 222.06808 g/mol.
Where can I buy 4-Phenylcoumarin?
You can request a quote for 4-Phenylcoumarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Phenylcoumarin?
Yes, CoreyChem provides custom synthesis services for 4-Phenylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.