3-Furyl(oxo)acetic acid
TL;DR: 3-Furyl(oxo)acetic acid (CAS 54280-70-5) is a chemical compound with molecular formula C6H4O4 and molecular weight 140.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(furan-3-yl)-2-oxoacetic acid
Also Known As: 3-furyl(oxo)acetic acid, 2-(furan-3-yl)-2-oxoacetic acid, 3-Furylglyoxylic acid, fur-3-ylglyoxylic acid, 3-Furanacetic acid, a-oxo-
| Molecular Formula | C6H4O4 |
|---|---|
| Molecular Weight | 140.01 g/mol |
| LogP | 0.5469 |
| Topological Polar Surface Area | 67.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.01096 |
| Heavy Atoms | 10 |
| Complexity | 246.72134 |
Chemical Identifiers
| CAS Number | 54280-70-5 |
|---|---|
| SMILES | C1=COC=C1C(=O)C(=O)O |
Product Overview
3-Furyl(oxo)acetic acid (CAS 54280-70-5), with molecular formula C6H4O4 and molecular weight 140.01 g/mol. IUPAC: 2-(furan-3-yl)-2-oxoacetic acid.
Chemical Property Profile of 3-Furyl(oxo)acetic acid
Property Insights of 3-Furyl(oxo)acetic acid
The XLogP value of 0.5469 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Furyl(oxo)acetic acid. The TPSA of 67.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Furyl(oxo)acetic acid. Following Lipinski's Rule of Five, 3-Furyl(oxo)acetic 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-Furyl(oxo)acetic acid?
The CAS number of 3-Furyl(oxo)acetic acid is 54280-70-5.
What is the molecular formula of 3-Furyl(oxo)acetic acid?
The molecular formula of 3-Furyl(oxo)acetic acid is C6H4O4.
What is the molecular weight of 3-Furyl(oxo)acetic acid?
The molecular weight of 3-Furyl(oxo)acetic acid is 140.01 g/mol.
Where can I buy 3-Furyl(oxo)acetic acid?
You can request a quote for 3-Furyl(oxo)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Furyl(oxo)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Furyl(oxo)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.