1,2,3,4-Tetrachloro-5,6-dinitrobenzene
TL;DR: 1,2,3,4-Tetrachloro-5,6-dinitrobenzene (CAS 781-15-7) is a chemical compound with molecular formula C6Cl4N2O4 and molecular weight 303.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrachloro-5,6-dinitrobenzene
Also Known As: 1,2,3,4-Tetrachloro-5,6-dinitrobenzene, 1,2-Dinitrotetrachlorobenzene, C6Cl4N2O4, tetrachlorodinitrobenzene, Benzene, tetrachlorodinitro-
| Molecular Formula | C6Cl4N2O4 |
|---|---|
| Molecular Weight | 303.86 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.85828 |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
Chemical Identifiers
| CAS Number | 781-15-7 |
|---|---|
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | XDIPOBQVBXLETD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4-Tetrachloro-5,6-dinitrobenzene (CAS 781-15-7), with molecular formula C6Cl4N2O4 and molecular weight 303.86 g/mol. IUPAC: 1,2,3,4-tetrachloro-5,6-dinitrobenzene.
Chemical Property Profile of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene
Property Insights of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene
The XLogP value of 3.4 indicates that 1,2,3,4-Tetrachloro-5,6-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 1,2,3,4-Tetrachloro-5,6-dinitrobenzene. Following Lipinski's Rule of Five, 1,2,3,4-Tetrachloro-5,6-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 1,2,3,4-Tetrachloro-5,6-dinitrobenzene?
The CAS number of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene is 781-15-7.
What is the molecular formula of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene?
The molecular formula of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene is C6Cl4N2O4.
What is the molecular weight of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene?
The molecular weight of 1,2,3,4-Tetrachloro-5,6-dinitrobenzene is 303.86 g/mol.
Where can I buy 1,2,3,4-Tetrachloro-5,6-dinitrobenzene?
You can request a quote for 1,2,3,4-Tetrachloro-5,6-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrachloro-5,6-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrachloro-5,6-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.