Tris(2,4-dinitrophenyl)methane
TL;DR: Tris(2,4-dinitrophenyl)methane (CAS 3626-18-4) is a chemical compound with molecular formula C19H10N6O12 and molecular weight 514.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[bis(2,4-dinitrophenyl)methyl]-2,4-dinitrobenzene
Also Known As: Tris(2,4-dinitrophenyl)methane, Methane, tris(2,4-dinitrophenyl)-, 1-[bis(2,4-dinitrophenyl)methyl]-2,4-dinitrobenzene, Benzene, 1,1',1''-methylidynetris(2,4-dinitro-, 2-Hydrazino-4-(5-nitro-2-furanyl)thiazole
| Molecular Formula | C19H10N6O12 |
|---|---|
| Molecular Weight | 514.04 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 275.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 3 |
| Exact Mass | 514.03564 |
| Heavy Atoms | 37 |
| Complexity | 812.0 |
Chemical Identifiers
| CAS Number | 3626-18-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])C(C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | OLARKHXGKLRWHE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tris(2,4-dinitrophenyl)methane (CAS 3626-18-4), with molecular formula C19H10N6O12 and molecular weight 514.04 g/mol. IUPAC: 1-[bis(2,4-dinitrophenyl)methyl]-2,4-dinitrobenzene.
Chemical Property Profile of Tris(2,4-dinitrophenyl)methane
Property Insights of Tris(2,4-dinitrophenyl)methane
The XLogP value of 4.3 indicates that Tris(2,4-dinitrophenyl)methane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 275.0 Ų indicates high polarity, suggesting Tris(2,4-dinitrophenyl)methane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tris(2,4-dinitrophenyl)methane has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tris(2,4-dinitrophenyl)methane?
The CAS number of Tris(2,4-dinitrophenyl)methane is 3626-18-4.
What is the molecular formula of Tris(2,4-dinitrophenyl)methane?
The molecular formula of Tris(2,4-dinitrophenyl)methane is C19H10N6O12.
What is the molecular weight of Tris(2,4-dinitrophenyl)methane?
The molecular weight of Tris(2,4-dinitrophenyl)methane is 514.04 g/mol.
Where can I buy Tris(2,4-dinitrophenyl)methane?
You can request a quote for Tris(2,4-dinitrophenyl)methane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(2,4-dinitrophenyl)methane?
Yes, KEHONG BIO provides custom synthesis services for Tris(2,4-dinitrophenyl)methane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.