6-Nitroveratraldehyde
TL;DR: 6-Nitroveratraldehyde (CAS 20357-25-9) is a chemical compound with molecular formula C9H9NO5 and molecular weight 211.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethoxy-2-nitrobenzaldehyde
Also Known As: 6-Nitroveratraldehyde, DMNB, 4,5-Dimethoxy-2-nitrobenzaldehyde, DNA-PK Inhibitor, Benzaldehyde, 4,5-dimethoxy-2-nitro-
| Molecular Formula | C9H9NO5 |
|---|---|
| Molecular Weight | 211.05 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 81.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.04807 |
| Heavy Atoms | 15 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 20357-25-9 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C=O)[N+](=O)[O-])OC |
| InChIKey | YWSPWKXREVSQCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Nitroveratraldehyde (CAS 20357-25-9), with molecular formula C9H9NO5 and molecular weight 211.05 g/mol. IUPAC: 4,5-dimethoxy-2-nitrobenzaldehyde.
Chemical Property Profile of 6-Nitroveratraldehyde
Property Insights of 6-Nitroveratraldehyde
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitroveratraldehyde. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitroveratraldehyde. Following Lipinski's Rule of Five, 6-Nitroveratraldehyde 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 6-Nitroveratraldehyde?
The CAS number of 6-Nitroveratraldehyde is 20357-25-9.
What is the molecular formula of 6-Nitroveratraldehyde?
The molecular formula of 6-Nitroveratraldehyde is C9H9NO5.
What is the molecular weight of 6-Nitroveratraldehyde?
The molecular weight of 6-Nitroveratraldehyde is 211.05 g/mol.
Where can I buy 6-Nitroveratraldehyde?
You can request a quote for 6-Nitroveratraldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitroveratraldehyde?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitroveratraldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.