6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid
TL;DR: 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid (CAS 6272-31-7) is a chemical compound with molecular formula C10H6O6 and molecular weight 222.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dihydroxy-2-oxochromene-4-carboxylic acid
Also Known As: 6,7-dihydroxy-2-oxochromene-4-carboxylic acid, 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid, 6,7-dihydroxy-2-oxo-2H-chromene-4-carboxylic acid
| Molecular Formula | C10H6O6 |
|---|---|
| Molecular Weight | 222.02 g/mol |
| LogP | 0.9024 |
| Topological Polar Surface Area | 107.97 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.01643 |
| Heavy Atoms | 16 |
| Complexity | 639.53467 |
Chemical Identifiers
| CAS Number | 6272-31-7 |
|---|---|
| SMILES | C1=C2C(=CC(=O)OC2=CC(=C1O)O)C(=O)O |
Product Overview
6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid (CAS 6272-31-7), with molecular formula C10H6O6 and molecular weight 222.02 g/mol. IUPAC: 6,7-dihydroxy-2-oxochromene-4-carboxylic acid.
Chemical Property Profile of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid
Property Insights of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid
The XLogP value of 0.9024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid. The TPSA of 107.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid. Following Lipinski's Rule of Five, 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid has 3 hydrogen bond donor(s) and 5 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 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid?
The CAS number of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid is 6272-31-7.
What is the molecular formula of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid?
The molecular formula of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid is C10H6O6.
What is the molecular weight of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid?
The molecular weight of 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid is 222.02 g/mol.
Where can I buy 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid?
You can request a quote for 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dihydroxy-2-oxo-2H-1-benzopyran-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.