3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid
TL;DR: 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid (CAS 329180-50-9) is a chemical compound with molecular formula C13H10O7 and molecular weight 278.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3a,8b-dihydroxy-2-(hydroxymethyl)-4-oxoindeno[1,2-b]furan-3-carboxylic acid
Also Known As: 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid, 3a,8b-dihydroxy-2-(hydroxymethyl)-4-oxoindeno[1,2-b]furan-3-carboxylic acid
| Molecular Formula | C13H10O7 |
|---|---|
| Molecular Weight | 278.04 g/mol |
| LogP | -0.8797 |
| Topological Polar Surface Area | 124.29 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.04266 |
| Heavy Atoms | 20 |
| Complexity | 677.0522 |
Chemical Identifiers
| CAS Number | 329180-50-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3(C2(OC(=C3C(=O)O)CO)O)O |
Product Overview
3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid (CAS 329180-50-9), with molecular formula C13H10O7 and molecular weight 278.04 g/mol. IUPAC: 3a,8b-dihydroxy-2-(hydroxymethyl)-4-oxoindeno[1,2-b]furan-3-carboxylic acid.
Chemical Property Profile of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid
Property Insights of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid
The XLogP value of -0.8797 indicates that 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 124.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid. Following Lipinski's Rule of Five, 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid has 4 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 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid?
The CAS number of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid is 329180-50-9.
What is the molecular formula of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid?
The molecular formula of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid is C13H10O7.
What is the molecular weight of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid?
The molecular weight of 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid is 278.04 g/mol.
Where can I buy 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid?
You can request a quote for 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3A,8b-dihydroxy-2-(hydroxymethyl)-4-oxo-4,8b-dihydro-3aH-indeno[1,2-b]furan-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.