3-Furoic acid
TL;DR: 3-Furoic acid (CAS 488-93-7) is a chemical compound with molecular formula C5H4O3 and molecular weight 112.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-3-carboxylic acid
Also Known As: 3-FUROIC ACID, furan-3-carboxylic acid, 3-Furancarboxylic acid, 3-Furanoic acid, 3-carboxyfuran
| Molecular Formula | C5H4O3 |
|---|---|
| Molecular Weight | 112.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.016045 |
| Heavy Atoms | 8 |
| Complexity | 99.0 |
| Melting Point | 120 - 122 °C |
| Solubility | 64 mg/mL |
Chemical Identifiers
| CAS Number | 488-93-7 |
|---|---|
| SMILES | C1=COC=C1C(=O)O |
| InChIKey | IHCCAYCGZOLTEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Furoic acid (CAS 488-93-7), with molecular formula C5H4O3 and molecular weight 112.02 g/mol. IUPAC: furan-3-carboxylic acid.
Chemical Property Profile of 3-Furoic acid
Property Insights of 3-Furoic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Furoic acid. With a topological polar surface area (TPSA) of 50.4 Ų, 3-Furoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Furoic 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-Furoic acid?
The CAS number of 3-Furoic acid is 488-93-7.
What is the molecular formula of 3-Furoic acid?
The molecular formula of 3-Furoic acid is C5H4O3.
What is the molecular weight of 3-Furoic acid?
The molecular weight of 3-Furoic acid is 112.02 g/mol.
Where can I buy 3-Furoic acid?
You can request a quote for 3-Furoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.