3-(4-Hydroxyphenyl)propionic acid
TL;DR: 3-(4-Hydroxyphenyl)propionic acid (CAS 501-97-3) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-hydroxyphenyl)propanoic acid
Also Known As: Phloretic acid, 3-(4-Hydroxyphenyl)propionic acid, desaminotyrosine, 3-(4-Hydroxyphenyl)propanoic acid, Hydro-p-coumaric acid
| Molecular Formula | C9H10O3 |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.06299 |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
| Melting Point | 129 °C |
Chemical Identifiers
| CAS Number | 501-97-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CCC(=O)O)O |
| InChIKey | NMHMNPHRMNGLLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(4-Hydroxyphenyl)propionic acid (CAS 501-97-3), with molecular formula C9H10O3 and molecular weight 166.06 g/mol. IUPAC: 3-(4-hydroxyphenyl)propanoic acid.
Chemical Property Profile of 3-(4-Hydroxyphenyl)propionic acid
Property Insights of 3-(4-Hydroxyphenyl)propionic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Hydroxyphenyl)propionic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 3-(4-Hydroxyphenyl)propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Hydroxyphenyl)propionic acid has 2 hydrogen bond donor(s) and 3 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-(4-Hydroxyphenyl)propionic acid?
The CAS number of 3-(4-Hydroxyphenyl)propionic acid is 501-97-3.
What is the molecular formula of 3-(4-Hydroxyphenyl)propionic acid?
The molecular formula of 3-(4-Hydroxyphenyl)propionic acid is C9H10O3.
What is the molecular weight of 3-(4-Hydroxyphenyl)propionic acid?
The molecular weight of 3-(4-Hydroxyphenyl)propionic acid is 166.06 g/mol.
Where can I buy 3-(4-Hydroxyphenyl)propionic acid?
You can request a quote for 3-(4-Hydroxyphenyl)propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Hydroxyphenyl)propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Hydroxyphenyl)propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.