1,3-Bis(benzoyloxy)benzene
TL;DR: 1,3-Bis(benzoyloxy)benzene (CAS 94-01-9) is a chemical compound with molecular formula C20H14O4 and molecular weight 318.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzoyloxyphenyl) benzoate
Also Known As: 1,3-Dibenzoyloxybenzene, Resorcinol dibenzoate, 1,3-Phenylene dibenzoate, m-Phenylene dibenzoate, Resorcinol, dibenzoate
| Molecular Formula | C20H14O4 |
|---|---|
| Molecular Weight | 318.09 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 318.0892 |
| Heavy Atoms | 24 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 94-01-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3 |
| InChIKey | SUQGLJRNDJRARS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Bis(benzoyloxy)benzene (CAS 94-01-9), with molecular formula C20H14O4 and molecular weight 318.09 g/mol. IUPAC: (3-benzoyloxyphenyl) benzoate.
Chemical Property Profile of 1,3-Bis(benzoyloxy)benzene
Property Insights of 1,3-Bis(benzoyloxy)benzene
The XLogP value of 5.0 indicates that 1,3-Bis(benzoyloxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 1,3-Bis(benzoyloxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis(benzoyloxy)benzene 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 1,3-Bis(benzoyloxy)benzene?
The CAS number of 1,3-Bis(benzoyloxy)benzene is 94-01-9.
What is the molecular formula of 1,3-Bis(benzoyloxy)benzene?
The molecular formula of 1,3-Bis(benzoyloxy)benzene is C20H14O4.
What is the molecular weight of 1,3-Bis(benzoyloxy)benzene?
The molecular weight of 1,3-Bis(benzoyloxy)benzene is 318.09 g/mol.
Where can I buy 1,3-Bis(benzoyloxy)benzene?
You can request a quote for 1,3-Bis(benzoyloxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis(benzoyloxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis(benzoyloxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.