2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione
TL;DR: 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione (CAS 294667-10-0) is a chemical compound with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione
Also Known As: BAS 00298152, 2-(2-hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione, 2-(2-Hydroxy-ethyl)-5-(4-nitro-phenoxy)-isoindole-1,3-dione, A0547/0025237, 2-(2-hydroxyethyl)-5-(4-nitrophenoxy)-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C16H12N2O6 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 328.06955 |
| Heavy Atoms | 24 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 294667-10-0 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2=CC3=C(C=C2)C(=O)N(C3=O)CCO |
| InChIKey | GJLLHKXQEXRKQN-UHFFFAOYSA-N |
Product Overview
2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione (CAS 294667-10-0), with molecular formula C16H12N2O6 and molecular weight 328.07 g/mol. IUPAC: 2-(2-hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione.
Chemical Property Profile of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione
Property Insights of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione. Following Lipinski's Rule of Five, 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione 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 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione?
The CAS number of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione is 294667-10-0.
What is the molecular formula of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione?
The molecular formula of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione is C16H12N2O6.
What is the molecular weight of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione?
The molecular weight of 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione is 328.07 g/mol.
Where can I buy 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione?
You can request a quote for 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Hydroxyethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.