3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid
TL;DR: 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid (CAS 63213-45-6) is a chemical compound with molecular formula C14H18O6 and molecular weight 282.11035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4,5-diethoxy-2-hydroxyphenyl)-4-oxobutanoic acid
Also Known As: AA 373, 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid, 4-(4,5-diethoxy-2-hydroxyphenyl)-4-oxobutanoic acid, 4,5-Diethoxy-2-hydroxy-gamma-oxobenzenebutanoic acid, Benzenebutanoic acid,4,5-diethoxy-2-hydroxy-g-oxo-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H18O6 |
| Molecular Weight | 282.11035 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 282.11035 Da |
| Heavy Atoms | 20 |
| Complexity | 330.0 |
| SMILES | CCOC1=C(C=C(C(=C1)C(=O)CCC(=O)O)O)OCC |
| InChIKey | DQYHRNYKHCEMSZ-UHFFFAOYSA-N |
Chemical Property Profile of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid
Property Insights of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid. Following Lipinski's Rule of Five, 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid has 2 hydrogen bond donor(s) and 6 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-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid?
The CAS number of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid is 63213-45-6.
What is the molecular formula of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid?
The molecular formula of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid is C14H18O6.
What is the molecular weight of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid?
The molecular weight of 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid is 282.11035 g/mol.
Where can I buy 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid?
You can request a quote for 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid?
Yes, CoreyChem provides custom synthesis services for 3-(2'-Hydroxy-4',5'-diethoxybenzoyl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.