TL;DR: 1,2,3,4-Tetrachloro-5-methylbenzene (CAS 1006-32-2) is a chemical compound with molecular formula C7H4Cl4 and molecular weight 227.90671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4-tetrachloro-5-methylbenzene
Also Known As: 1,2,3,4-tetrachloro-5-methylbenzene, 2,3,4,5-TETRACHLOROTOLUENE, TETRACHLOROTOLUENE, starbld0006267, Benzene, 1,2,3,4-tetrachloro-5-methyl-
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H4Cl4 |
| Molecular Weight | 227.90671 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.90376 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| SMILES | CC1=CC(=C(C(=C1Cl)Cl)Cl)Cl |
| InChIKey | ZLELNPSBDOUFHN-UHFFFAOYSA-N |
The XLogP value of 5.1 indicates that 1,2,3,4-Tetrachloro-5-methylbenzene 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-Tetrachloro-5-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrachloro-5-methylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,2,3,4-Tetrachloro-5-methylbenzene is 1006-32-2.
The molecular formula of 1,2,3,4-Tetrachloro-5-methylbenzene is C7H4Cl4.
The molecular weight of 1,2,3,4-Tetrachloro-5-methylbenzene is 227.90671 g/mol.
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