4,6-Di-tert-butyl-2-chloro-3-methylphenol
TL;DR: 4,6-Di-tert-butyl-2-chloro-3-methylphenol (CAS 70173-23-8) is a chemical compound with molecular formula C15H23ClO and molecular weight 254.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-ditert-butyl-2-chloro-3-methylphenol
Also Known As: 4,6-di-tert-butyl-2-chloro-3-methylphenol, 4,6-ditert-butyl-2-chloro-3-methylphenol, 2-chloro-3-methyl-4,6-di-t-butylphenol, 2-chloro-3-methyl-4,6-ditert-butyl-phenol, RefChem:285721
| Molecular Formula | C15H23ClO |
|---|---|
| Molecular Weight | 254.14 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.14374 |
| Heavy Atoms | 17 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 70173-23-8 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1C(C)(C)C)C(C)(C)C)O)Cl |
| InChIKey | CIAHODRPDSCRPQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,6-Di-tert-butyl-2-chloro-3-methylphenol (CAS 70173-23-8), with molecular formula C15H23ClO and molecular weight 254.14 g/mol. IUPAC: 4,6-ditert-butyl-2-chloro-3-methylphenol.
Chemical Property Profile of 4,6-Di-tert-butyl-2-chloro-3-methylphenol
Property Insights of 4,6-Di-tert-butyl-2-chloro-3-methylphenol
The XLogP value of 5.9 indicates that 4,6-Di-tert-butyl-2-chloro-3-methylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 4,6-Di-tert-butyl-2-chloro-3-methylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,6-Di-tert-butyl-2-chloro-3-methylphenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,6-Di-tert-butyl-2-chloro-3-methylphenol?
The CAS number of 4,6-Di-tert-butyl-2-chloro-3-methylphenol is 70173-23-8.
What is the molecular formula of 4,6-Di-tert-butyl-2-chloro-3-methylphenol?
The molecular formula of 4,6-Di-tert-butyl-2-chloro-3-methylphenol is C15H23ClO.
What is the molecular weight of 4,6-Di-tert-butyl-2-chloro-3-methylphenol?
The molecular weight of 4,6-Di-tert-butyl-2-chloro-3-methylphenol is 254.14 g/mol.
Where can I buy 4,6-Di-tert-butyl-2-chloro-3-methylphenol?
You can request a quote for 4,6-Di-tert-butyl-2-chloro-3-methylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Di-tert-butyl-2-chloro-3-methylphenol?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Di-tert-butyl-2-chloro-3-methylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.