2,3,6-Trichloroanisole
TL;DR: 2,3,6-Trichloroanisole (CAS 50375-10-5) is a chemical compound with molecular formula C7H5Cl3O and molecular weight 209.9406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4-trichloro-3-methoxybenzene
Also Known As: 2,3,6-TRICHLOROANISOLE, 1,2,4-Trichloro-3-methoxybenzene, Benzene, 1,2,4-trichloro-3-methoxy-, 2,5,6-Trichloroanisole, 2,3,6-TRICHLOROANISOL
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5Cl3O |
| Molecular Weight | 209.9406 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.9406 Da |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
| SMILES | COC1=C(C=CC(=C1Cl)Cl)Cl |
| InChIKey | OTFNCXLUCRUNCH-UHFFFAOYSA-N |
Chemical Property Profile of 2,3,6-Trichloroanisole
Property Insights of 2,3,6-Trichloroanisole
The XLogP value of 4.0 indicates that 2,3,6-Trichloroanisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2,3,6-Trichloroanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,6-Trichloroanisole has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,3,6-Trichloroanisole?
The CAS number of 2,3,6-Trichloroanisole is 50375-10-5.
What is the molecular formula of 2,3,6-Trichloroanisole?
The molecular formula of 2,3,6-Trichloroanisole is C7H5Cl3O.
What is the molecular weight of 2,3,6-Trichloroanisole?
The molecular weight of 2,3,6-Trichloroanisole is 209.9406 g/mol.
Where can I buy 2,3,6-Trichloroanisole?
You can request a quote for 2,3,6-Trichloroanisole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3,6-Trichloroanisole?
Yes, CoreyChem provides custom synthesis services for 2,3,6-Trichloroanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.