![[Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol structure](/static/products/2486/24866-72-6.webp)
[Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol
TL;DR: [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol (CAS 24866-72-6) is a chemical compound with molecular formula C20H16N4O9 and molecular weight 456.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol
Also Known As: [phenyl(pyridin-4-yl)methyl] acetate,2,4,6-trinitrophenol|[Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol|[phenyl(pyridin-4-yl)methyl] acetate; 2,4,6-trinitrophenol|Phenyl(pyridin-4-yl)methyl acetate--2,4,6-trinitrophenol (1/1)
| Molecular Formula | C20H16N4O9 |
|---|---|
| Molecular Weight | 456.09 g/mol |
| LogP | 3.8509 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 456.09174 |
| Heavy Atoms | 33 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 24866-72-6 |
|---|---|
| SMILES | CC(=O)OC(C1=CC=CC=C1)C2=CC=NC=C2.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | FHKSXMXRABVHGR-UHFFFAOYSA-N |
Product Overview
[Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol (CAS 24866-72-6), with molecular formula C20H16N4O9 and molecular weight 456.09 g/mol. IUPAC: [phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol.
Chemical Property Profile of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol
Property Insights of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol
The XLogP value of 3.8509 indicates that [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 197.0 Ų indicates high polarity, suggesting [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol has 1 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 [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol?
The CAS number of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol is 24866-72-6.
What is the molecular formula of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol?
The molecular formula of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol is C20H16N4O9.
What is the molecular weight of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol?
The molecular weight of [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol is 456.09 g/mol.
Where can I buy [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol?
You can request a quote for [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol?
Yes, KEHONG BIO provides custom synthesis services for [Phenyl(pyridin-4-yl)methyl] acetate;2,4,6-trinitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.