2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione
TL;DR: 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione (CAS 28434-96-0) is a chemical compound with molecular formula C12H6N2O5 and molecular weight 258.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione
Also Known As: 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione, BAS 00384079, 2-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione, 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-hydroxy-6-nitro-, AH-034/08852047
| Molecular Formula | C12H6N2O5 |
|---|---|
| Molecular Weight | 258.03 g/mol |
| LogP | 1.7332 |
| Topological Polar Surface Area | 100.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.02768 |
| Heavy Atoms | 19 |
| Complexity | 745.79895 |
Chemical Identifiers
| CAS Number | 28434-96-0 |
|---|---|
| SMILES | C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)O)[N+](=O)[O-] |
Product Overview
2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione (CAS 28434-96-0), with molecular formula C12H6N2O5 and molecular weight 258.03 g/mol. IUPAC: 2-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione.
Chemical Property Profile of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione
Property Insights of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione
The XLogP value of 1.7332 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione. The TPSA of 100.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione has 1 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-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione?
The CAS number of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione is 28434-96-0.
What is the molecular formula of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione?
The molecular formula of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione is C12H6N2O5.
What is the molecular weight of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione?
The molecular weight of 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione is 258.03 g/mol.
Where can I buy 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione?
You can request a quote for 2-Hydroxy-6-nitro-benzo[de]isoquinoline-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-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.