2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate
TL;DR: 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate (CAS 424798-89-0) is a chemical compound with molecular formula C17H13FO5 and molecular weight 316.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 4-fluorobenzoate
Also Known As: BAS 03370567, AB00730690-01, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate, [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 4-fluorobenzoate, 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-oxoethyl 4-fluorobenzoate
| Molecular Formula | C17H13FO5 |
|---|---|
| Molecular Weight | 316.07 g/mol |
| LogP | 2.6366 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.0747 |
| Heavy Atoms | 23 |
| Complexity | 739.149 |
Chemical Identifiers
| CAS Number | 424798-89-0 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)C(=O)COC(=O)C3=CC=C(C=C3)F |
Product Overview
2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate (CAS 424798-89-0), with molecular formula C17H13FO5 and molecular weight 316.07 g/mol. IUPAC: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl] 4-fluorobenzoate.
Chemical Property Profile of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate
Property Insights of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate
The XLogP value of 2.6366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate. Following Lipinski's Rule of Five, 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate has 0 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 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate?
The CAS number of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate is 424798-89-0.
What is the molecular formula of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate?
The molecular formula of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate is C17H13FO5.
What is the molecular weight of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate?
The molecular weight of 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate is 316.07 g/mol.
Where can I buy 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate?
You can request a quote for 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.