Quintozene
TL;DR: Quintozene (CAS 82-68-8) is a chemical compound with molecular formula C6Cl5NO2 and molecular weight 292.83716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4,5-pentachloro-6-nitrobenzene
Also Known As: Quintozene, PENTACHLORONITROBENZENE, Brassicol, Fartox, Terrachlor
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6Cl5NO2 |
| Molecular Weight | 292.83716 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 294.83423 Da |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
| Melting Point | 295 °F (NTP, 1992) |
| Boiling Point | 622 °F at 760 mmHg (with some decomposition) (NTP, 1992) |
| Density | 1.718 at 77 °F (NTP, 1992) - Denser than water; will sink |
| Vapor Pressure | 0.013 mmHg at 77 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| SMILES | C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-] |
| InChIKey | LKPLKUMXSAEKID-UHFFFAOYSA-N |
Product Description
Applications: Quintozene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Quintozene is a heterocyclic building block identified by CAS number 82-68-8 and the molecular formula C6Cl5NO2 and a molecular weight of 292.84 g/mol. Physically, the compound has a density of 1.718 at 77 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 72 °F (NTP, 1992). Synonyms include Quintozene and PENTACHLORONITROBENZENE.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Quintozene
Property Insights of Quintozene
The XLogP value of 4.2 indicates that Quintozene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, Quintozene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quintozene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Quintozene?
The CAS number of Quintozene is 82-68-8.
What is the molecular formula of Quintozene?
The molecular formula of Quintozene is C6Cl5NO2.
What is the molecular weight of Quintozene?
The molecular weight of Quintozene is 292.83716 g/mol.
What are the applications of Quintozene?
Quintozene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Quintozene?
You can request a quote for Quintozene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Quintozene?
Yes, CoreyChem provides custom synthesis services for Quintozene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.