2,3,4-Trichloro-1,5-dinitrobenzene
TL;DR: 2,3,4-Trichloro-1,5-dinitrobenzene (CAS 6379-46-0) is a chemical compound with molecular formula C6HCl3N2O4 and molecular weight 269.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4-trichloro-1,5-dinitrobenzene
Also Known As: Vancide PB, 2,3,4-trichloro-1,5-dinitrobenzene, Anagrelide impurity 3, 1,2,3-TRICHLORO-4,6-DINITROBENZENE, TCDNB
| Molecular Formula | C6HCl3N2O4 |
|---|---|
| Molecular Weight | 269.90 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 269.90018 |
| Heavy Atoms | 15 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 6379-46-0 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)Cl)Cl)[N+](=O)[O-] |
| InChIKey | WUMOEIUPWHYXBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4-Trichloro-1,5-dinitrobenzene (CAS 6379-46-0), with molecular formula C6HCl3N2O4 and molecular weight 269.90 g/mol. IUPAC: 2,3,4-trichloro-1,5-dinitrobenzene.
Chemical Property Profile of 2,3,4-Trichloro-1,5-dinitrobenzene
Property Insights of 2,3,4-Trichloro-1,5-dinitrobenzene
The XLogP value of 3.1 indicates that 2,3,4-Trichloro-1,5-dinitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4-Trichloro-1,5-dinitrobenzene. Following Lipinski's Rule of Five, 2,3,4-Trichloro-1,5-dinitrobenzene has 0 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 2,3,4-Trichloro-1,5-dinitrobenzene?
The CAS number of 2,3,4-Trichloro-1,5-dinitrobenzene is 6379-46-0.
What is the molecular formula of 2,3,4-Trichloro-1,5-dinitrobenzene?
The molecular formula of 2,3,4-Trichloro-1,5-dinitrobenzene is C6HCl3N2O4.
What is the molecular weight of 2,3,4-Trichloro-1,5-dinitrobenzene?
The molecular weight of 2,3,4-Trichloro-1,5-dinitrobenzene is 269.90 g/mol.
Where can I buy 2,3,4-Trichloro-1,5-dinitrobenzene?
You can request a quote for 2,3,4-Trichloro-1,5-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trichloro-1,5-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trichloro-1,5-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.