1,2,3,4-Tetrachlorobenzene
TL;DR: 1,2,3,4-Tetrachlorobenzene (CAS 634-66-2) is a chemical compound with molecular formula C6H2Cl4 and molecular weight 213.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4-tetrachlorobenzene
Also Known As: 1,2,3,4-TETRACHLOROBENZENE, Tetrachlorobenzene, Caswell No. 825, Benzene, 1,2,3,4-tetrachloro-, Benzene, tetrachloro-
| Molecular Formula | C6H2Cl4 |
|---|---|
| Molecular Weight | 213.89 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.8881 |
| Heavy Atoms | 10 |
| Complexity | 102.0 |
| Melting Point | 113 to 46.1 °C |
| Boiling Point | 253.9 °C at 760 mmHg |
| Density | 1.70 kg/l |
| Solubility | less than 1 mg/mL at 70 °F (NTP, 1992) |
| Flash Point | greater than 112.8 °C |
| Vapor Pressure | 1 mmHg at 68.5 °C ; 5 mmHg at 99.6 °C; 760 mmHg at 253.9 °C |
Chemical Identifiers
| CAS Number | 634-66-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1Cl)Cl)Cl)Cl |
| InChIKey | GBDZXPJXOMHESU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4-Tetrachlorobenzene (CAS 634-66-2), with molecular formula C6H2Cl4 and molecular weight 213.89 g/mol. IUPAC: 1,2,3,4-tetrachlorobenzene.
Chemical Property Profile of 1,2,3,4-Tetrachlorobenzene
Property Insights of 1,2,3,4-Tetrachlorobenzene
The XLogP value of 4.6 indicates that 1,2,3,4-Tetrachlorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2,3,4-Tetrachlorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrachlorobenzene has 0 hydrogen bond donor(s) and 0 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-Tetrachlorobenzene?
The CAS number of 1,2,3,4-Tetrachlorobenzene is 634-66-2.
What is the molecular formula of 1,2,3,4-Tetrachlorobenzene?
The molecular formula of 1,2,3,4-Tetrachlorobenzene is C6H2Cl4.
What is the molecular weight of 1,2,3,4-Tetrachlorobenzene?
The molecular weight of 1,2,3,4-Tetrachlorobenzene is 213.89 g/mol.
Where can I buy 1,2,3,4-Tetrachlorobenzene?
You can request a quote for 1,2,3,4-Tetrachlorobenzene 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-Tetrachlorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrachlorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.