4-Hydroxy-3-Nitroacetophenone
TL;DR: 4-Hydroxy-3-Nitroacetophenone (CAS 6322-56-1) is a chemical compound with molecular formula C8H7NO4 and molecular weight 181.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hydroxy-3-nitrophenyl)ethanone
Also Known As: 4'-Hydroxy-3'-nitroacetophenone, 4-Hydroxy-3-Nitroacetophenone, 1-(4-hydroxy-3-nitrophenyl)ethanone, null, 4-acetyl-2-nitro-phenol
| Molecular Formula | C8H7NO4 |
|---|---|
| Molecular Weight | 181.04 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 | 181.0375 |
| Heavy Atoms | 13 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 6322-56-1 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)O)[N+](=O)[O-] |
| InChIKey | MMNKVWGVSHRIJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-3-Nitroacetophenone (CAS 6322-56-1), with molecular formula C8H7NO4 and molecular weight 181.04 g/mol. IUPAC: 1-(4-hydroxy-3-nitrophenyl)ethanone.
Chemical Property Profile of 4-Hydroxy-3-Nitroacetophenone
Property Insights of 4-Hydroxy-3-Nitroacetophenone
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3-Nitroacetophenone. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-3-Nitroacetophenone. Following Lipinski's Rule of Five, 4-Hydroxy-3-Nitroacetophenone 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-Hydroxy-3-Nitroacetophenone?
The CAS number of 4-Hydroxy-3-Nitroacetophenone is 6322-56-1.
What is the molecular formula of 4-Hydroxy-3-Nitroacetophenone?
The molecular formula of 4-Hydroxy-3-Nitroacetophenone is C8H7NO4.
What is the molecular weight of 4-Hydroxy-3-Nitroacetophenone?
The molecular weight of 4-Hydroxy-3-Nitroacetophenone is 181.04 g/mol.
Where can I buy 4-Hydroxy-3-Nitroacetophenone?
You can request a quote for 4-Hydroxy-3-Nitroacetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3-Nitroacetophenone?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3-Nitroacetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.