2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate
TL;DR: 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate (CAS 672273-06-2) is a chemical compound with molecular formula C18H14O6 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-4-yl) 3,4-dimethoxybenzoate
Also Known As: 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate, (2-oxochromen-4-yl) 3,4-dimethoxybenzoate
| Molecular Formula | C18H14O6 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.07904 |
| Heavy Atoms | 24 |
| Complexity | 514.0 |
Chemical Identifiers
| CAS Number | 672273-06-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)OC2=CC(=O)OC3=CC=CC=C32)OC |
| InChIKey | SVMQUKKEMLHRMC-UHFFFAOYSA-N |
Product Overview
2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate (CAS 672273-06-2), with molecular formula C18H14O6 and molecular weight 326.08 g/mol. IUPAC: (2-oxochromen-4-yl) 3,4-dimethoxybenzoate.
Chemical Property Profile of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate
Property Insights of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate
The XLogP value of 3.0 indicates that 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate. Following Lipinski's Rule of Five, 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate has 0 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-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate?
The CAS number of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate is 672273-06-2.
What is the molecular formula of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate?
The molecular formula of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate is C18H14O6.
What is the molecular weight of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate?
The molecular weight of 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate is 326.08 g/mol.
Where can I buy 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate?
You can request a quote for 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-oxo-2H-chromen-4-yl 3,4-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.