![4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid structure](/static/products/3147/314741-98-5.webp)
4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid
TL;DR: 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid (CAS 314741-98-5) is a chemical compound with molecular formula C18H14O5 and molecular weight 310.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-methyl-2-oxochromen-7-yl)oxymethyl]benzoic acid
Also Known As: 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid, 4-(4-Methyl-2-oxo-2H-chromen-7-yloxymethyl)-benzoic acid, 4-[(4-methyl-2-oxochromen-7-yl)oxymethyl]benzoic acid, 4-(((4-Methyl-2-oxo-2h-chromen-7-yl)oxy)methyl)benzoic acid, 4-[(4-methyl-2-oxo-chromen-7-yl)oxymethyl]benzoic Acid
| Molecular Formula | C18H14O5 |
|---|---|
| Molecular Weight | 310.08 g/mol |
| LogP | 3.37862 |
| Topological Polar Surface Area | 76.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 310.08414 |
| Heavy Atoms | 23 |
| Complexity | 922.29 |
Chemical Identifiers
| CAS Number | 314741-98-5 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)C(=O)O |
Product Overview
4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid (CAS 314741-98-5), with molecular formula C18H14O5 and molecular weight 310.08 g/mol. IUPAC: 4-[(4-methyl-2-oxochromen-7-yl)oxymethyl]benzoic acid.
Chemical Property Profile of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid
Property Insights of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid
The XLogP value of 3.37862 indicates that 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid. Following Lipinski's Rule of Five, 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid has 1 hydrogen bond donor(s) and 4 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 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid?
The CAS number of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid is 314741-98-5.
What is the molecular formula of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid?
The molecular formula of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid is C18H14O5.
What is the molecular weight of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid?
The molecular weight of 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid is 310.08 g/mol.
Where can I buy 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid?
You can request a quote for 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]methyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.