2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid
TL;DR: 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid (CAS 16426-62-3) is a chemical compound with molecular formula C7H6O6 and molecular weight 186.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(carboxymethyl)-5-oxo-2H-furan-3-carboxylic acid
Also Known As: 2-(carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid, 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate, 4-Carboxy-2,5-dihydro-2-oxofuran-5-acetate, 3-Carboxy-5(2H)-oxofuran-2-acetic acid, 2-(carboxymethyl)-5-oxo-2H-furan-3-carboxylic acid
| Molecular Formula | C7H6O6 |
|---|---|
| Molecular Weight | 186.02 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.01643 |
| Heavy Atoms | 13 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 16426-62-3 |
|---|---|
| SMILES | C1=C(C(OC1=O)CC(=O)O)C(=O)O |
| InChIKey | QPUXSMUBBURPLF-UHFFFAOYSA-N |
Product Overview
2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid (CAS 16426-62-3), with molecular formula C7H6O6 and molecular weight 186.02 g/mol. IUPAC: 2-(carboxymethyl)-5-oxo-2H-furan-3-carboxylic acid.
Chemical Property Profile of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid
Property Insights of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid
The XLogP value of -1.0 indicates that 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid. Following Lipinski's Rule of Five, 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid has 2 hydrogen bond donor(s) and 6 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 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid?
The CAS number of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid is 16426-62-3.
What is the molecular formula of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid?
The molecular formula of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid is C7H6O6.
What is the molecular weight of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid?
The molecular weight of 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid is 186.02 g/mol.
Where can I buy 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid?
You can request a quote for 2-(Carboxymethyl)-5-oxo-2,5-dihydro-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 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Carboxymethyl)-5-oxo-2,5-dihydro-3-furoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.