TL;DR: Homovanillic Acid (CAS 306-08-1) is a chemical compound with molecular formula C9H10O4 and molecular weight 182.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-hydroxy-3-methoxyphenyl)acetic acid
Also Known As: Homovanillic acid, 4-Hydroxy-3-methoxyphenylacetic acid, Vanillacetic acid, Homovanillate, Vanilacetic acid
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H10O4 |
| Molecular Weight | 182.0579 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.0579 Da |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
| Melting Point | 138 - 140 °C |
| Vapor Pressure | 0.00000823 [mmHg] |
| Solubility | 17 mg/mL |
| SMILES | COC1=C(C=CC(=C1)CC(=O)O)O |
| InChIKey | QRMZSPFSDQBLIX-UHFFFAOYSA-N |
Applications: Homovanillic Acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Homovanillic Acid (CAS 306-08-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Homovanillic Acid (CAS 306-08-1) is a pharmaceutical intermediate with the molecular formula C9H10O4 and a molecular weight of 182.06 g/mol. Key physical properties include a solubility: 17 mg/mL. It is also known as Homovanillic acid and 4-Hydroxy-3-methoxyphenylacetic acid.
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.
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Homovanillic Acid. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Homovanillic Acid. Following Lipinski's Rule of Five, Homovanillic Acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Homovanillic Acid is 306-08-1.
The molecular formula of Homovanillic Acid is C9H10O4.
The molecular weight of Homovanillic Acid is 182.0579 g/mol.
Homovanillic Acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Homovanillic Acid (CAS 306-08-1) with...
You can request a quote for Homovanillic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
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