6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
TL;DR: 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid (CAS 15728-06-0) is a chemical compound with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanoic acid
Also Known As: 2-anilinopropionic acid, 6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanoic acid, 6-(3-nitrophthalimidyl)-caproic acid, 3-nitro-N-(5-carboxypentyl)phthalimide, BAS 00031025
| Molecular Formula | C14H14N2O6 |
|---|---|
| Molecular Weight | 306.09 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 306.08517 |
| Heavy Atoms | 22 |
| Complexity | 486.0 |
Chemical Identifiers
| CAS Number | 15728-06-0 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)N(C2=O)CCCCCC(=O)O |
| InChIKey | RDDDCNAVGLYHTA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid (CAS 15728-06-0), with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol. IUPAC: 6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanoic acid.
Chemical Property Profile of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
Property Insights of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid. Following Lipinski's Rule of Five, 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid has 1 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 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The CAS number of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is 15728-06-0.
What is the molecular formula of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The molecular formula of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is C14H14N2O6.
What is the molecular weight of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The molecular weight of 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is 306.09 g/mol.
Where can I buy 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
You can request a quote for 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.