1,2-Dimethoxy-4,5-dinitrobenzene
TL;DR: 1,2-Dimethoxy-4,5-dinitrobenzene (CAS 6970-07-6) is a chemical compound with molecular formula C8H8N2O6 and molecular weight 228.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dimethoxy-4,5-dinitrobenzene
Also Known As: 1,2-Dimethoxy-4,5-dinitrobenzene, 4,5-dinitroveratrole, 4,5-Dinitro veratrole, 1,2-dimethoxy-4,5-dinitro-benzene, 4,5-Dinitroveratrol
| Molecular Formula | C8H8N2O6 |
|---|---|
| Molecular Weight | 228.04 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.03824 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 6970-07-6 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)[N+](=O)[O-])[N+](=O)[O-])OC |
| InChIKey | WFDHPWTYKOAFBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dimethoxy-4,5-dinitrobenzene (CAS 6970-07-6), with molecular formula C8H8N2O6 and molecular weight 228.04 g/mol. IUPAC: 1,2-dimethoxy-4,5-dinitrobenzene.
Chemical Property Profile of 1,2-Dimethoxy-4,5-dinitrobenzene
Property Insights of 1,2-Dimethoxy-4,5-dinitrobenzene
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dimethoxy-4,5-dinitrobenzene. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dimethoxy-4,5-dinitrobenzene. Following Lipinski's Rule of Five, 1,2-Dimethoxy-4,5-dinitrobenzene has 0 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 1,2-Dimethoxy-4,5-dinitrobenzene?
The CAS number of 1,2-Dimethoxy-4,5-dinitrobenzene is 6970-07-6.
What is the molecular formula of 1,2-Dimethoxy-4,5-dinitrobenzene?
The molecular formula of 1,2-Dimethoxy-4,5-dinitrobenzene is C8H8N2O6.
What is the molecular weight of 1,2-Dimethoxy-4,5-dinitrobenzene?
The molecular weight of 1,2-Dimethoxy-4,5-dinitrobenzene is 228.04 g/mol.
Where can I buy 1,2-Dimethoxy-4,5-dinitrobenzene?
You can request a quote for 1,2-Dimethoxy-4,5-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dimethoxy-4,5-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dimethoxy-4,5-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.