2,6-Dinitro-4-nonylphenol
TL;DR: 2,6-Dinitro-4-nonylphenol (CAS 4097-34-1) is a chemical compound with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dinitro-4-nonylphenol
Also Known As: 2,6-Dinitro-4-nonylphenol, Brandol, 4-n-Nonyl-2,6-dinitrophenol, Phenol,2,6-dinitro-4-nonyl-, Phenol, 2,6-dinitro-4-nonyl-
| Molecular Formula | C15H22N2O5 |
|---|---|
| Molecular Weight | 310.15 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.15286 |
| Heavy Atoms | 22 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 4097-34-1 |
|---|---|
| SMILES | CCCCCCCCCC1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-] |
| InChIKey | JWXOAOUZIHUGMP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dinitro-4-nonylphenol (CAS 4097-34-1), with molecular formula C15H22N2O5 and molecular weight 310.15 g/mol. IUPAC: 2,6-dinitro-4-nonylphenol.
Chemical Property Profile of 2,6-Dinitro-4-nonylphenol
Property Insights of 2,6-Dinitro-4-nonylphenol
The XLogP value of 6.4 indicates that 2,6-Dinitro-4-nonylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,6-Dinitro-4-nonylphenol. Following Lipinski's Rule of Five, 2,6-Dinitro-4-nonylphenol has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Dinitro-4-nonylphenol?
The CAS number of 2,6-Dinitro-4-nonylphenol is 4097-34-1.
What is the molecular formula of 2,6-Dinitro-4-nonylphenol?
The molecular formula of 2,6-Dinitro-4-nonylphenol is C15H22N2O5.
What is the molecular weight of 2,6-Dinitro-4-nonylphenol?
The molecular weight of 2,6-Dinitro-4-nonylphenol is 310.15 g/mol.
Where can I buy 2,6-Dinitro-4-nonylphenol?
You can request a quote for 2,6-Dinitro-4-nonylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dinitro-4-nonylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dinitro-4-nonylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.