4-羟基-3-硝基苯甲醛
TL;DR: 4-羟基-3-硝基苯甲醛 (CAS 3011-34-5) is a chemical compound with molecular formula C7H5NO4 and molecular weight 167.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-羟基-3-硝基苯甲醛
4-hydroxy-3-nitrobenzaldehyde
Also Known As: 4-Hydroxy-3-nitrobenzaldehyde, null, 4-FORMYL-2-NITROPHENOL, Benzaldehyde, 4-hydroxy-3-nitro-, Amodiaquine Impurity 3
| Molecular Formula | C7H5NO4 |
|---|---|
| Molecular Weight | 167.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 167.02185 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 3011-34-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=O)[N+](=O)[O-])O |
| InChIKey | YTHJCZRFJGXPTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-羟基-3-硝基苯甲醛 (CAS 3011-34-5), with molecular formula C7H5NO4 and molecular weight 167.02 g/mol. IUPAC: 4-hydroxy-3-nitrobenzaldehyde.
Chemical Property Profile of 4-羟基-3-硝基苯甲醛
Property Insights of 4-羟基-3-硝基苯甲醛
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-羟基-3-硝基苯甲醛. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-羟基-3-硝基苯甲醛. Following Lipinski's Rule of Five, 4-羟基-3-硝基苯甲醛 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 4-羟基-3-硝基苯甲醛?
The CAS number of 4-羟基-3-硝基苯甲醛 is 3011-34-5.
What is the molecular formula of 4-羟基-3-硝基苯甲醛?
The molecular formula of 4-羟基-3-硝基苯甲醛 is C7H5NO4.
What is the molecular weight of 4-羟基-3-硝基苯甲醛?
The molecular weight of 4-羟基-3-硝基苯甲醛 is 167.02 g/mol.
Where can I buy 4-羟基-3-硝基苯甲醛?
You can request a quote for 4-羟基-3-硝基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-羟基-3-硝基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 4-羟基-3-硝基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.