3-(5-Phenylfuran-2-yl)propanoic acid
TL;DR: 3-(5-Phenylfuran-2-yl)propanoic acid (CAS 3465-61-0) is a chemical compound with molecular formula C13H12O3 and molecular weight 216.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-phenylfuran-2-yl)propanoic acid
Also Known As: 3-(5-Phenyl-2-furyl)propanoic acid, 3-(5-phenylfuran-2-yl)propanoic acid, 3- propanoicacid, 2-(Benzyloxy)pyridine, 3-(5-Phenyl-furan-2-yl)-propionic acid
| Molecular Formula | C13H12O3 |
|---|---|
| Molecular Weight | 216.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 216.07864 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 3465-61-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)O |
| InChIKey | JKBUDDSGMWGQDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(5-Phenylfuran-2-yl)propanoic acid (CAS 3465-61-0), with molecular formula C13H12O3 and molecular weight 216.08 g/mol. IUPAC: 3-(5-phenylfuran-2-yl)propanoic acid.
Chemical Property Profile of 3-(5-Phenylfuran-2-yl)propanoic acid
Property Insights of 3-(5-Phenylfuran-2-yl)propanoic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Phenylfuran-2-yl)propanoic acid. With a topological polar surface area (TPSA) of 50.4 Ų, 3-(5-Phenylfuran-2-yl)propanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-Phenylfuran-2-yl)propanoic acid has 1 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-(5-Phenylfuran-2-yl)propanoic acid?
The CAS number of 3-(5-Phenylfuran-2-yl)propanoic acid is 3465-61-0.
What is the molecular formula of 3-(5-Phenylfuran-2-yl)propanoic acid?
The molecular formula of 3-(5-Phenylfuran-2-yl)propanoic acid is C13H12O3.
What is the molecular weight of 3-(5-Phenylfuran-2-yl)propanoic acid?
The molecular weight of 3-(5-Phenylfuran-2-yl)propanoic acid is 216.08 g/mol.
Where can I buy 3-(5-Phenylfuran-2-yl)propanoic acid?
You can request a quote for 3-(5-Phenylfuran-2-yl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Phenylfuran-2-yl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Phenylfuran-2-yl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.