Ethyl 3-(benzoyloxy)benzoate
TL;DR: Ethyl 3-(benzoyloxy)benzoate (CAS 33696-05-8) is a chemical compound with molecular formula C16H14O4 and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-benzoyloxybenzoate
Also Known As: ethyl 3-(benzoyloxy)benzoate, ethyl 3-benzoyloxybenzoate, 3-(ethoxycarbonyl)phenyl benzoate, 3-benzoyloxy-benzoic acid ethyl ester, ethyl 3-[(phenylcarbonyl)oxy]benzoate
| Molecular Formula | C16H14O4 |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 3.0825 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 270.0892 |
| Heavy Atoms | 20 |
| Complexity | 604.8837 |
Chemical Identifiers
| CAS Number | 33696-05-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=CC=C1)OC(=O)C2=CC=CC=C2 |
Product Overview
Ethyl 3-(benzoyloxy)benzoate (CAS 33696-05-8), with molecular formula C16H14O4 and molecular weight 270.09 g/mol. IUPAC: ethyl 3-benzoyloxybenzoate.
Chemical Property Profile of Ethyl 3-(benzoyloxy)benzoate
Property Insights of Ethyl 3-(benzoyloxy)benzoate
The XLogP value of 3.0825 indicates that Ethyl 3-(benzoyloxy)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl 3-(benzoyloxy)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(benzoyloxy)benzoate has 0 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 Ethyl 3-(benzoyloxy)benzoate?
The CAS number of Ethyl 3-(benzoyloxy)benzoate is 33696-05-8.
What is the molecular formula of Ethyl 3-(benzoyloxy)benzoate?
The molecular formula of Ethyl 3-(benzoyloxy)benzoate is C16H14O4.
What is the molecular weight of Ethyl 3-(benzoyloxy)benzoate?
The molecular weight of Ethyl 3-(benzoyloxy)benzoate is 270.09 g/mol.
Where can I buy Ethyl 3-(benzoyloxy)benzoate?
You can request a quote for Ethyl 3-(benzoyloxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(benzoyloxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(benzoyloxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.