3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione
TL;DR: 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione (CAS 104555-01-3) is a chemical compound with molecular formula C12H10O5 and molecular weight 234.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-(4-methoxyphenyl)pyran-2,5-dione
Also Known As: 3-hydroxy-4-(4-methoxyphenyl)pyran-2,5-dione, 3-Hydroxy-4-(4-methoxyphenyl)(2H)pyran-2,5(6H)-dione, 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione, 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dion
| Molecular Formula | C12H10O5 |
|---|---|
| Molecular Weight | 234.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 234.05283 |
| Heavy Atoms | 17 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 104555-01-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=C(C(=O)OCC2=O)O |
| InChIKey | IYJKYBJIEWHVJL-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione (CAS 104555-01-3), with molecular formula C12H10O5 and molecular weight 234.05 g/mol. IUPAC: 3-hydroxy-4-(4-methoxyphenyl)pyran-2,5-dione.
Chemical Property Profile of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione
Property Insights of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione. Following Lipinski's Rule of Five, 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione has 1 hydrogen bond donor(s) and 5 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 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione?
The CAS number of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione is 104555-01-3.
What is the molecular formula of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione?
The molecular formula of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione is C12H10O5.
What is the molecular weight of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione?
The molecular weight of 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione is 234.05 g/mol.
Where can I buy 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione?
You can request a quote for 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-4-(4-methoxyphenyl)-2H-pyran-2,5(6H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.