2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid
TL;DR: 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid (CAS 7702-03-6) is a chemical compound with molecular formula C16H9NO6 and molecular weight 311.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-carboxyphenyl)-1,3-dioxoisoindole-5-carboxylic acid
Also Known As: 2-(4-CARBOXYPHENYL)-1,3-DIOXOISOINDOLINE-5-CARBOXYLIC ACID, N-(4-Carboxyphenyl)trimellitimide, BAS 00084698, 2-(4-carboxyphenyl)-1,3-dioxoisoindole-5-carboxylic acid, 4-carboxy-N-(p-carboxyphenyl)phthalimide
| Molecular Formula | C16H9NO6 |
|---|---|
| Molecular Weight | 311.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 311.043 |
| Heavy Atoms | 23 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 7702-03-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O |
| InChIKey | PRBOQCWKGNKHPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid (CAS 7702-03-6), with molecular formula C16H9NO6 and molecular weight 311.04 g/mol. IUPAC: 2-(4-carboxyphenyl)-1,3-dioxoisoindole-5-carboxylic acid.
Chemical Property Profile of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid
Property Insights of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid. Following Lipinski's Rule of Five, 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic 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 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid?
The CAS number of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid is 7702-03-6.
What is the molecular formula of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid?
The molecular formula of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid is C16H9NO6.
What is the molecular weight of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid?
The molecular weight of 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid is 311.04 g/mol.
Where can I buy 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid?
You can request a quote for 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Carboxyphenyl)-1,3-dioxoisoindoline-5-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.