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2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione
TL;DR: 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione (CAS 30777-83-4) is a chemical compound with molecular formula C15H10N2O5 and molecular weight 298.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-nitrophenyl)methoxy]isoindole-1,3-dione
Also Known As: 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione, N-(2-nitrobenzyloxy)phthalimide, 2-[(2-nitrophenyl)methoxy]isoindole-1,3-dione, 2-((2-Nitrobenzyl)oxy)isoindoline-1,3-dione, 1H-Isoindole-1,3(2H)-dione, 2-[(2-nitrophenyl)methoxy]-
| Molecular Formula | C15H10N2O5 |
|---|---|
| Molecular Weight | 298.06 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.05896 |
| Heavy Atoms | 22 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 30777-83-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CON2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-] |
| InChIKey | UCMHYRMMWUXXTF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione (CAS 30777-83-4), with molecular formula C15H10N2O5 and molecular weight 298.06 g/mol. IUPAC: 2-[(2-nitrophenyl)methoxy]isoindole-1,3-dione.
Chemical Property Profile of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione
Property Insights of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione. Following Lipinski's Rule of Five, 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 5 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-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione?
The CAS number of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione is 30777-83-4.
What is the molecular formula of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione?
The molecular formula of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione is C15H10N2O5.
What is the molecular weight of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione?
The molecular weight of 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione is 298.06 g/mol.
Where can I buy 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione?
You can request a quote for 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-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-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2-nitrobenzyl)oxy]-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.