3-Methoxy-2,6-dinitrobenzaldehyde
TL;DR: 3-Methoxy-2,6-dinitrobenzaldehyde (CAS 10202-94-5) is a chemical compound with molecular formula C8H6N2O6 and molecular weight 226.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-2,6-dinitrobenzaldehyde
Also Known As: 3-methoxy-2,6-dinitrobenzaldehyde, 2,6-bisnitro-3-methoxybenzaldehyde, 3-methoxy-2,6-dinitro-benzaldehyde, Benzaldehyde,3-methoxy-2,6-dinitro-, AE-018/31856019
| Molecular Formula | C8H6N2O6 |
|---|---|
| Molecular Weight | 226.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 226.02258 |
| Heavy Atoms | 16 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 10202-94-5 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)[N+](=O)[O-] |
| InChIKey | JXXLAXCQRPYPLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxy-2,6-dinitrobenzaldehyde (CAS 10202-94-5), with molecular formula C8H6N2O6 and molecular weight 226.02 g/mol. IUPAC: 3-methoxy-2,6-dinitrobenzaldehyde.
Chemical Property Profile of 3-Methoxy-2,6-dinitrobenzaldehyde
Property Insights of 3-Methoxy-2,6-dinitrobenzaldehyde
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-2,6-dinitrobenzaldehyde. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methoxy-2,6-dinitrobenzaldehyde. Following Lipinski's Rule of Five, 3-Methoxy-2,6-dinitrobenzaldehyde 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 3-Methoxy-2,6-dinitrobenzaldehyde?
The CAS number of 3-Methoxy-2,6-dinitrobenzaldehyde is 10202-94-5.
What is the molecular formula of 3-Methoxy-2,6-dinitrobenzaldehyde?
The molecular formula of 3-Methoxy-2,6-dinitrobenzaldehyde is C8H6N2O6.
What is the molecular weight of 3-Methoxy-2,6-dinitrobenzaldehyde?
The molecular weight of 3-Methoxy-2,6-dinitrobenzaldehyde is 226.02 g/mol.
Where can I buy 3-Methoxy-2,6-dinitrobenzaldehyde?
You can request a quote for 3-Methoxy-2,6-dinitrobenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-2,6-dinitrobenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-2,6-dinitrobenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.