4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid
TL;DR: 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid (CAS 3753-05-7) is a chemical compound with molecular formula C16H14O6 and molecular weight 302.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-carboxyphenoxy)ethoxy]benzoic acid
Also Known As: Ethylene Glycol Bis(4-carboxyphenyl) Ether, 2-Hexyldecanoicacid, 4-[2-(4-carboxyphenoxy)ethoxy]benzoic acid, 1,2-Bis(4-carboxyphenoxy)ethane, 4,4'-(Ethane-1,2-diylbis(oxy))dibenzoic acid
| Molecular Formula | C16H14O6 |
|---|---|
| Molecular Weight | 302.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.07904 |
| Heavy Atoms | 22 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 3753-05-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)OCCOC2=CC=C(C=C2)C(=O)O |
| InChIKey | VAXBLYWAVAIJJJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid (CAS 3753-05-7), with molecular formula C16H14O6 and molecular weight 302.08 g/mol. IUPAC: 4-[2-(4-carboxyphenoxy)ethoxy]benzoic acid.
Chemical Property Profile of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid
Property Insights of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid. Following Lipinski's Rule of Five, 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid has 2 hydrogen bond donor(s) and 6 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 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid?
The CAS number of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid is 3753-05-7.
What is the molecular formula of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid?
The molecular formula of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid is C16H14O6.
What is the molecular weight of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid?
The molecular weight of 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid is 302.08 g/mol.
Where can I buy 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid?
You can request a quote for 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,4'-(1,2-Ethanediylbis(oxy))bisbenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.