![ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate structure](/static/products/162/162665-01-2.png)
ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate
TL;DR: ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate (CAS 162665-01-2) is a chemical compound with molecular formula C21H18O7 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
Also Known As: ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate, ethyl 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate
| Molecular Formula | C21H18O7 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.6334 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 382.10526 |
| Heavy Atoms | 28 |
| Complexity | 1143.6798 |
Chemical Identifiers
| CAS Number | 162665-01-2 |
|---|---|
| SMILES | CCC1=CC2=C(C=C1O)OC(=C(C2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCC |
Product Overview
ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate (CAS 162665-01-2), with molecular formula C21H18O7 and molecular weight 382.11 g/mol. IUPAC: ethyl 3-(1,3-benzodioxol-5-yl)-6-ethyl-7-hydroxy-4-oxochromene-2-carboxylate.
Chemical Property Profile of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate
Property Insights of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate
The XLogP value of 3.6334 indicates that ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate. Following Lipinski's Rule of Five, ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate has 1 hydrogen bond donor(s) and 7 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 ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate?
The CAS number of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is 162665-01-2.
What is the molecular formula of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate?
The molecular formula of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is C21H18O7.
What is the molecular weight of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate?
The molecular weight of ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate is 382.11 g/mol.
Where can I buy ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate?
You can request a quote for ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(benzo[d][1,3]dioxol-5-yl)-6-ethyl-7-hydroxy-4-oxo-4H-chromene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.