1,3-Benzodioxol-5-yl 4-ethoxybenzoate
TL;DR: 1,3-Benzodioxol-5-yl 4-ethoxybenzoate (CAS 109262-07-9) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzodioxol-5-yl 4-ethoxybenzoate
Also Known As: 1,3-benzodioxol-5-yl 4-ethoxybenzoate, AO-548/43179585
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 3.0332 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 648.217 |
Chemical Identifiers
| CAS Number | 109262-07-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)OCO3 |
Product Overview
1,3-Benzodioxol-5-yl 4-ethoxybenzoate (CAS 109262-07-9), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: 1,3-benzodioxol-5-yl 4-ethoxybenzoate.
Chemical Property Profile of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate
Property Insights of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate
The XLogP value of 3.0332 indicates that 1,3-Benzodioxol-5-yl 4-ethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.99 Ų, 1,3-Benzodioxol-5-yl 4-ethoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxol-5-yl 4-ethoxybenzoate 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 1,3-Benzodioxol-5-yl 4-ethoxybenzoate?
The CAS number of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate is 109262-07-9.
What is the molecular formula of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate?
The molecular formula of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate is C16H14O5.
What is the molecular weight of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate?
The molecular weight of 1,3-Benzodioxol-5-yl 4-ethoxybenzoate is 286.08 g/mol.
Where can I buy 1,3-Benzodioxol-5-yl 4-ethoxybenzoate?
You can request a quote for 1,3-Benzodioxol-5-yl 4-ethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzodioxol-5-yl 4-ethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzodioxol-5-yl 4-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.