8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid
TL;DR: 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid (CAS 170807-34-8) is a chemical compound with molecular formula C19H14O6 and molecular weight 338.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(7-methyl-4-oxochromen-2-yl)-4H-1,3-benzodioxine-6-carboxylic acid
Also Known As: 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid, 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-1,3-benzodioxine-6-carboxylic acid, 8-(7-methyl-4-oxochromen-2-yl)-4H-1,3-benzodioxine-6-carboxylic acid, 2-(7-methyl-4-oxo-chromen-2-yl)-8,10-dioxabicyclo[4.4.0]deca-2,4,11-triene-4-carboxylic Acid
| Molecular Formula | C19H14O6 |
|---|---|
| Molecular Weight | 338.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.07904 |
| Heavy Atoms | 25 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 170807-34-8 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC(=CC4=C3OCOC4)C(=O)O |
| InChIKey | XFYAPNAMMCBSLQ-UHFFFAOYSA-N |
Product Overview
8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid (CAS 170807-34-8), with molecular formula C19H14O6 and molecular weight 338.08 g/mol. IUPAC: 8-(7-methyl-4-oxochromen-2-yl)-4H-1,3-benzodioxine-6-carboxylic acid.
Chemical Property Profile of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid
Property Insights of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid. Following Lipinski's Rule of Five, 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid has 1 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 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid?
The CAS number of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid is 170807-34-8.
What is the molecular formula of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid?
The molecular formula of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid is C19H14O6.
What is the molecular weight of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid?
The molecular weight of 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid is 338.08 g/mol.
Where can I buy 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid?
You can request a quote for 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 8-(7-methyl-4-oxo-4H-chromen-2-yl)-4H-benzo[d][1,3]dioxine-6-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.