Benzoic acid, 4,4'-oxybis-, diphenyl ester
TL;DR: Benzoic acid, 4,4'-oxybis-, diphenyl ester (CAS 2187-85-1) is a chemical compound with molecular formula C26H18O5 and molecular weight 410.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 4-(4-phenoxycarbonylphenoxy)benzoate
Also Known As: diphenyl 4,4'-oxydibenzoate, 4,4'-Oxybis(phenyl benzoate), Benzoic acid, 4,4'-oxybis-, diphenyl ester, BAS 00084922, phenyl 4-[4-(phenoxycarbonyl)phenoxy]benzoate
| Molecular Formula | C26H18O5 |
|---|---|
| Molecular Weight | 410.12 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.11542 |
| Heavy Atoms | 31 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 2187-85-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)C(=O)OC4=CC=CC=C4 |
| InChIKey | IGAMXLXXKPNRAC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 4,4'-oxybis-, diphenyl ester (CAS 2187-85-1), with molecular formula C26H18O5 and molecular weight 410.12 g/mol. IUPAC: phenyl 4-(4-phenoxycarbonylphenoxy)benzoate.
Chemical Property Profile of Benzoic acid, 4,4'-oxybis-, diphenyl ester
Property Insights of Benzoic acid, 4,4'-oxybis-, diphenyl ester
The XLogP value of 6.5 indicates that Benzoic acid, 4,4'-oxybis-, diphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4,4'-oxybis-, diphenyl ester. Following Lipinski's Rule of Five, Benzoic acid, 4,4'-oxybis-, diphenyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 4,4'-oxybis-, diphenyl ester?
The CAS number of Benzoic acid, 4,4'-oxybis-, diphenyl ester is 2187-85-1.
What is the molecular formula of Benzoic acid, 4,4'-oxybis-, diphenyl ester?
The molecular formula of Benzoic acid, 4,4'-oxybis-, diphenyl ester is C26H18O5.
What is the molecular weight of Benzoic acid, 4,4'-oxybis-, diphenyl ester?
The molecular weight of Benzoic acid, 4,4'-oxybis-, diphenyl ester is 410.12 g/mol.
Where can I buy Benzoic acid, 4,4'-oxybis-, diphenyl ester?
You can request a quote for Benzoic acid, 4,4'-oxybis-, diphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4,4'-oxybis-, diphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4,4'-oxybis-, diphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.