alpha,2,3,4-Tetrachlorotoluene
TL;DR: alpha,2,3,4-Tetrachlorotoluene (CAS 13911-02-9) 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-trichloro-4-(chloromethyl)benzene
Also Known As: alpha,2,3,4-Tetrachlorotoluene, 1,2,3-trichloro-4-(chloromethyl)benzene, TRICHLOROBENZYLCHLORIDE, Trichloro(chloromethyl)benzene, 2,3,4-Trichlorobenzyl chloride
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H4Cl4 |
| Molecular Weight | 227.90671 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.90376 Da |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
| SMILES | C1=CC(=C(C(=C1CCl)Cl)Cl)Cl |
| InChIKey | ZZGCZMFHUSKZIE-UHFFFAOYSA-N |
Chemical Property Profile of alpha,2,3,4-Tetrachlorotoluene
Property Insights of alpha,2,3,4-Tetrachlorotoluene
The XLogP value of 4.2 indicates that alpha,2,3,4-Tetrachlorotoluene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, alpha,2,3,4-Tetrachlorotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha,2,3,4-Tetrachlorotoluene 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
What is the CAS number of alpha,2,3,4-Tetrachlorotoluene?
The CAS number of alpha,2,3,4-Tetrachlorotoluene is 13911-02-9.
What is the molecular formula of alpha,2,3,4-Tetrachlorotoluene?
The molecular formula of alpha,2,3,4-Tetrachlorotoluene is C7H4Cl4.
What is the molecular weight of alpha,2,3,4-Tetrachlorotoluene?
The molecular weight of alpha,2,3,4-Tetrachlorotoluene is 227.90671 g/mol.
Where can I buy alpha,2,3,4-Tetrachlorotoluene?
You can request a quote for alpha,2,3,4-Tetrachlorotoluene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha,2,3,4-Tetrachlorotoluene?
Yes, CoreyChem provides custom synthesis services for alpha,2,3,4-Tetrachlorotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.