4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol
TL;DR: 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol (CAS 56866-34-3) is a chemical compound with molecular formula C13H8N4O10 and molecular weight 380.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol
Also Known As: 4,4'-methanediylbis(2,6-dinitrophenol), 4,4'-Methylenebis(2,6-dinitrophenol), 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol, 4-(4-hydroxy-3,5-dinitrobenzyl)-2,6-dinitrophenol, 4-[(4-hydroxy-3,5-dinitro-phenyl)methyl]-2,6-dinitro-phenol
| Molecular Formula | C13H8N4O10 |
|---|---|
| Molecular Weight | 380.02 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 224.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 2 |
| Exact Mass | 380.02405 |
| Heavy Atoms | 27 |
| Complexity | 508.0 |
Chemical Identifiers
| CAS Number | 56866-34-3 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])CC2=CC(=C(C(=C2)[N+](=O)[O-])O)[N+](=O)[O-] |
| InChIKey | HWPJOGXDDWSUFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol (CAS 56866-34-3), with molecular formula C13H8N4O10 and molecular weight 380.02 g/mol. IUPAC: 4-[(4-hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol.
Chemical Property Profile of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol
Property Insights of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol
The XLogP value of 3.6 indicates that 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 224.0 Ų indicates high polarity, suggesting 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol has 2 hydrogen bond donor(s) and 10 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-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol?
The CAS number of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol is 56866-34-3.
What is the molecular formula of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol?
The molecular formula of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol is C13H8N4O10.
What is the molecular weight of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol?
The molecular weight of 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol is 380.02 g/mol.
Where can I buy 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol?
You can request a quote for 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 4-[(4-Hydroxy-3,5-dinitrophenyl)methyl]-2,6-dinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.