2-Nitrobenzaldoxime
TL;DR: 2-Nitrobenzaldoxime (CAS 6635-41-2) is a chemical compound with molecular formula C7H6N2O3 and molecular weight 166.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-nitrophenyl)methylidene]hydroxylamine
Also Known As: 2-Nitrobenzaldoxime, 2-Nitrobenzaldehyde oxime, o-Nitrobenzaldoxim, o-Nitrobenzaldoxime, Benzaldehyde, 2-nitro-,oxime
| Molecular Formula | C7H6N2O3 |
|---|---|
| Molecular Weight | 166.04 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 78.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 166.03784 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 6635-41-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=NO)[N+](=O)[O-] |
| InChIKey | IHMGDCCTWRRUDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Nitrobenzaldoxime (CAS 6635-41-2), with molecular formula C7H6N2O3 and molecular weight 166.04 g/mol. IUPAC: N-[(2-nitrophenyl)methylidene]hydroxylamine.
Chemical Property Profile of 2-Nitrobenzaldoxime
Property Insights of 2-Nitrobenzaldoxime
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Nitrobenzaldoxime. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Nitrobenzaldoxime. Following Lipinski's Rule of Five, 2-Nitrobenzaldoxime has 1 hydrogen bond donor(s) and 4 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-Nitrobenzaldoxime?
The CAS number of 2-Nitrobenzaldoxime is 6635-41-2.
What is the molecular formula of 2-Nitrobenzaldoxime?
The molecular formula of 2-Nitrobenzaldoxime is C7H6N2O3.
What is the molecular weight of 2-Nitrobenzaldoxime?
The molecular weight of 2-Nitrobenzaldoxime is 166.04 g/mol.
Where can I buy 2-Nitrobenzaldoxime?
You can request a quote for 2-Nitrobenzaldoxime directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Nitrobenzaldoxime?
Yes, KEHONG BIO provides custom synthesis services for 2-Nitrobenzaldoxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.