4-Tert-butyl-2,6-dichlorophenol
TL;DR: 4-Tert-butyl-2,6-dichlorophenol (CAS 34593-75-4) is a chemical compound with molecular formula C10H12Cl2O and molecular weight 218.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-2,6-dichlorophenol
Also Known As: 4-Tert-butyl-2,6-dichlorophenol, 4-(tert-butyl)-2,6-dichlorophenol, 2,6-dichloro-4-t-butylphenol, 2,6-Dichloro-4-tert-butylphenol, C(C)(C)(C)c1cc(Cl)c(O)c(Cl)c1
| Molecular Formula | C10H12Cl2O |
|---|---|
| Molecular Weight | 218.03 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.02652 |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 34593-75-4 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)Cl)O)Cl |
| InChIKey | RETRALMQVUXTPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Tert-butyl-2,6-dichlorophenol (CAS 34593-75-4), with molecular formula C10H12Cl2O and molecular weight 218.03 g/mol. IUPAC: 4-tert-butyl-2,6-dichlorophenol.
Chemical Property Profile of 4-Tert-butyl-2,6-dichlorophenol
Property Insights of 4-Tert-butyl-2,6-dichlorophenol
The XLogP value of 4.5 indicates that 4-Tert-butyl-2,6-dichlorophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Tert-butyl-2,6-dichlorophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-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
Frequently Asked Questions
What is the CAS number of 4-Tert-butyl-2,6-dichlorophenol?
The CAS number of 4-Tert-butyl-2,6-dichlorophenol is 34593-75-4.
What is the molecular formula of 4-Tert-butyl-2,6-dichlorophenol?
The molecular formula of 4-Tert-butyl-2,6-dichlorophenol is C10H12Cl2O.
What is the molecular weight of 4-Tert-butyl-2,6-dichlorophenol?
The molecular weight of 4-Tert-butyl-2,6-dichlorophenol is 218.03 g/mol.
Where can I buy 4-Tert-butyl-2,6-dichlorophenol?
You can request a quote for 4-Tert-butyl-2,6-dichlorophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-2,6-dichlorophenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-2,6-dichlorophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.