![4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid structure](/static/products/4320/432012-46-9.webp)
4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid
TL;DR: 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid (CAS 432012-46-9) is a chemical compound with molecular formula C21H12ClNO5 and molecular weight 393.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid
Also Known As: 4-[4-(4-chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid, 4-(4-(4-chlorophenoxy)-1,3-dioxoisoindolin-2-yl)benzoic acid, 4-[4-(4-chlorophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoic acid
| Molecular Formula | C21H12ClNO5 |
|---|---|
| Molecular Weight | 393.04 g/mol |
| LogP | 4.6311 |
| Topological Polar Surface Area | 83.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 393.0404 |
| Heavy Atoms | 28 |
| Complexity | 1106.6448 |
Chemical Identifiers
| CAS Number | 432012-46-9 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)OC3=CC=C(C=C3)Cl)C(=O)N(C2=O)C4=CC=C(C=C4)C(=O)O |
Product Overview
4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid (CAS 432012-46-9), with molecular formula C21H12ClNO5 and molecular weight 393.04 g/mol. IUPAC: 4-[4-(4-chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid.
Chemical Property Profile of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid
Property Insights of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid
The XLogP value of 4.6311 indicates that 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid. Following Lipinski's Rule of Five, 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid has 1 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 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid?
The CAS number of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid is 432012-46-9.
What is the molecular formula of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid?
The molecular formula of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid is C21H12ClNO5.
What is the molecular weight of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid?
The molecular weight of 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid is 393.04 g/mol.
Where can I buy 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid?
You can request a quote for 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic 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-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-Chlorophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.