bis(4-carboxyphenyl)terephthalate
TL;DR: bis(4-carboxyphenyl)terephthalate (CAS 79403-39-7) is a chemical compound with molecular formula C22H14O8 and molecular weight 406.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-carboxyphenoxy)carbonylbenzoyl]oxybenzoic acid
Also Known As: bis(4-carboxyphenyl)terephthalate, 4,4 -(Terephthaloylbisoxy)dibenzoic acid, Terephthalic acid bis(4-carboxyphenyl) ester, 4,4'-[benzene-1,4-diylbis(carbonyloxy)]dibenzoic acid, 4-[4-(4-carboxyphenoxy)carbonylbenzoyl]oxybenzoic Acid
| Molecular Formula | C22H14O8 |
|---|---|
| Molecular Weight | 406.07 g/mol |
| LogP | 3.5214 |
| Topological Polar Surface Area | 127.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.06888 |
| Heavy Atoms | 30 |
| Complexity | 1006.8843 |
Chemical Identifiers
| CAS Number | 79403-39-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)C(=O)O)C(=O)OC3=CC=C(C=C3)C(=O)O |
Product Overview
bis(4-carboxyphenyl)terephthalate (CAS 79403-39-7), with molecular formula C22H14O8 and molecular weight 406.07 g/mol. IUPAC: 4-[4-(4-carboxyphenoxy)carbonylbenzoyl]oxybenzoic acid.
Chemical Property Profile of bis(4-carboxyphenyl)terephthalate
Property Insights of bis(4-carboxyphenyl)terephthalate
The XLogP value of 3.5214 indicates that bis(4-carboxyphenyl)terephthalate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.2 Ų falls within the moderate polarity range, balancing permeability and solubility for bis(4-carboxyphenyl)terephthalate. Following Lipinski's Rule of Five, bis(4-carboxyphenyl)terephthalate 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 bis(4-carboxyphenyl)terephthalate?
The CAS number of bis(4-carboxyphenyl)terephthalate is 79403-39-7.
What is the molecular formula of bis(4-carboxyphenyl)terephthalate?
The molecular formula of bis(4-carboxyphenyl)terephthalate is C22H14O8.
What is the molecular weight of bis(4-carboxyphenyl)terephthalate?
The molecular weight of bis(4-carboxyphenyl)terephthalate is 406.07 g/mol.
Where can I buy bis(4-carboxyphenyl)terephthalate?
You can request a quote for bis(4-carboxyphenyl)terephthalate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bis(4-carboxyphenyl)terephthalate?
Yes, KEHONG BIO provides custom synthesis services for bis(4-carboxyphenyl)terephthalate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.