1-Methoxy-2,3-dinitrobenzene
TL;DR: 1-Methoxy-2,3-dinitrobenzene (CAS 16315-07-4) is a chemical compound with molecular formula C7H6N2O5 and molecular weight 198.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-2,3-dinitrobenzene
Also Known As: 1-methoxy-2,3-dinitrobenzene, Dinitroanisole, Dinitroanisol, 2,3-dinitroanisole, 1-Methoxy-2,3-dinitro-benzene
| Molecular Formula | C7H6N2O5 |
|---|---|
| Molecular Weight | 198.03 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.02766 |
| Heavy Atoms | 14 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 16315-07-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | OIGDISKECPMPBN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxy-2,3-dinitrobenzene (CAS 16315-07-4), with molecular formula C7H6N2O5 and molecular weight 198.03 g/mol. IUPAC: 1-methoxy-2,3-dinitrobenzene.
Chemical Property Profile of 1-Methoxy-2,3-dinitrobenzene
Property Insights of 1-Methoxy-2,3-dinitrobenzene
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxy-2,3-dinitrobenzene. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxy-2,3-dinitrobenzene. Following Lipinski's Rule of Five, 1-Methoxy-2,3-dinitrobenzene 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 1-Methoxy-2,3-dinitrobenzene?
The CAS number of 1-Methoxy-2,3-dinitrobenzene is 16315-07-4.
What is the molecular formula of 1-Methoxy-2,3-dinitrobenzene?
The molecular formula of 1-Methoxy-2,3-dinitrobenzene is C7H6N2O5.
What is the molecular weight of 1-Methoxy-2,3-dinitrobenzene?
The molecular weight of 1-Methoxy-2,3-dinitrobenzene is 198.03 g/mol.
Where can I buy 1-Methoxy-2,3-dinitrobenzene?
You can request a quote for 1-Methoxy-2,3-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxy-2,3-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-2,3-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.