2-Acetyl-3-(benzoyloxy)phenyl benzoate
TL;DR: 2-Acetyl-3-(benzoyloxy)phenyl benzoate (CAS 40296-16-0) is a chemical compound with molecular formula C22H16O5 and molecular weight 360.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-acetyl-3-benzoyloxyphenyl) benzoate
Also Known As: 2-acetyl-3-(benzoyloxy)phenyl benzoate, (2-acetyl-3-benzoyloxyphenyl) benzoate, (2-acetyl-3-benzoyloxy-phenyl) Benzoate, Bis(benzoic acid)2-acetyl-m-phenylene ester, J1.847.541C
| Molecular Formula | C22H16O5 |
|---|---|
| Molecular Weight | 360.10 g/mol |
| LogP | 4.3276 |
| Topological Polar Surface Area | 69.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.09976 |
| Heavy Atoms | 27 |
| Complexity | 906.3497 |
Chemical Identifiers
| CAS Number | 40296-16-0 |
|---|---|
| SMILES | CC(=O)C1=C(C=CC=C1OC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3 |
Product Overview
2-Acetyl-3-(benzoyloxy)phenyl benzoate (CAS 40296-16-0), with molecular formula C22H16O5 and molecular weight 360.10 g/mol. IUPAC: (2-acetyl-3-benzoyloxyphenyl) benzoate.
Chemical Property Profile of 2-Acetyl-3-(benzoyloxy)phenyl benzoate
Property Insights of 2-Acetyl-3-(benzoyloxy)phenyl benzoate
The XLogP value of 4.3276 indicates that 2-Acetyl-3-(benzoyloxy)phenyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetyl-3-(benzoyloxy)phenyl benzoate. Following Lipinski's Rule of Five, 2-Acetyl-3-(benzoyloxy)phenyl benzoate 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-Acetyl-3-(benzoyloxy)phenyl benzoate?
The CAS number of 2-Acetyl-3-(benzoyloxy)phenyl benzoate is 40296-16-0.
What is the molecular formula of 2-Acetyl-3-(benzoyloxy)phenyl benzoate?
The molecular formula of 2-Acetyl-3-(benzoyloxy)phenyl benzoate is C22H16O5.
What is the molecular weight of 2-Acetyl-3-(benzoyloxy)phenyl benzoate?
The molecular weight of 2-Acetyl-3-(benzoyloxy)phenyl benzoate is 360.10 g/mol.
Where can I buy 2-Acetyl-3-(benzoyloxy)phenyl benzoate?
You can request a quote for 2-Acetyl-3-(benzoyloxy)phenyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetyl-3-(benzoyloxy)phenyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetyl-3-(benzoyloxy)phenyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.