![3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid structure](/static/products/1612/161291-80-1.webp)
3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid
TL;DR: 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid (CAS 161291-80-1) is a chemical compound with molecular formula C19H11NO4 and molecular weight 317.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-dioxobenzo[f]isoindol-2-yl)benzoic acid
Also Known As: 3-(1,3-dioxobenzo[f]isoindol-2-yl)benzoic acid, 3-(1,3-dioxonaphtho[2,3-c]azolin-2-yl)benzoic acid, 3-(1,3-dioxo-1H-benzo[f]isoindol-2(3H)-yl)benzoic acid, 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid
| Molecular Formula | C19H11NO4 |
|---|---|
| Molecular Weight | 317.07 g/mol |
| LogP | 3.3386 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.06882 |
| Heavy Atoms | 24 |
| Complexity | 983.9712 |
Chemical Identifiers
| CAS Number | 161291-80-1 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)O |
Product Overview
3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid (CAS 161291-80-1), with molecular formula C19H11NO4 and molecular weight 317.07 g/mol. IUPAC: 3-(1,3-dioxobenzo[f]isoindol-2-yl)benzoic acid.
Chemical Property Profile of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid
Property Insights of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid
The XLogP value of 3.3386 indicates that 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid. Following Lipinski's Rule of Five, 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid has 1 hydrogen bond donor(s) and 3 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 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid?
The CAS number of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid is 161291-80-1.
What is the molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid?
The molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid is C19H11NO4.
What is the molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid?
The molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid is 317.07 g/mol.
Where can I buy 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid?
You can request a quote for 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-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 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-dioxo-1,3-dihydro-2H-benzo[f]isoindol-2-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.