2,6-Dichlorophenol
TL;DR: 2,6-Dichlorophenol (CAS 87-65-0) is a chemical compound with molecular formula C6H4Cl2O and molecular weight 161.96391 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dichlorophenol
Also Known As: 2,6-DICHLOROPHENOL, Phenol, 2,6-dichloro-, 2,6-Dichlorfenol, 2,6-dichlorphenol, 2,6-dichloro-phenol
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4Cl2O |
| Molecular Weight | 161.96391 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.96391 Da |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
| Melting Point | 154 to 156 °F (NTP, 1992) |
| Boiling Point | 424 to 428 °F at 760 mmHg (NTP, 1992) |
| Density | 1.653 g/cu cm at 20 °C |
| Vapor Pressure | 1 mmHg at 139.1 °F ; 5 mmHg at 189.7 °F; 10 mmHg at 213.8 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 68 °F (NTP, 1992) |
| SMILES | C1=CC(=C(C(=C1)Cl)O)Cl |
| InChIKey | HOLHYSJJBXSLMV-UHFFFAOYSA-N |
Product Description
Applications: 2,6-Dichlorophenol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2,6-Dichlorophenol (CAS 87-65-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2,6-Dichlorophenol is a heterocyclic building block identified by CAS number 87-65-0 and the molecular formula C6H4Cl2O and a molecular weight of 161.96 g/mol. Physically, the compound has a density of 1.653 g/cu cm at 20 °C g/cm³, a solubility: less than 1 mg/mL at 68 °F (NTP, 1992). It is also known as 2,6-DICHLOROPHENOL and Phenol, 2,6-dichloro-.
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 2,6-Dichlorophenol
Property Insights of 2,6-Dichlorophenol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dichlorophenol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,6-Dichlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichlorophenol has 1 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 2,6-Dichlorophenol?
The CAS number of 2,6-Dichlorophenol is 87-65-0.
What is the molecular formula of 2,6-Dichlorophenol?
The molecular formula of 2,6-Dichlorophenol is C6H4Cl2O.
What is the molecular weight of 2,6-Dichlorophenol?
The molecular weight of 2,6-Dichlorophenol is 161.96391 g/mol.
What are the applications of 2,6-Dichlorophenol?
2,6-Dichlorophenol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 2,6-Dichlorophenol?
You can request a quote for 2,6-Dichlorophenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Dichlorophenol?
Yes, CoreyChem provides custom synthesis services for 2,6-Dichlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.