2-Chloro-4,6-di-tert-amylphenol
TL;DR: 2-Chloro-4,6-di-tert-amylphenol (CAS 42350-99-2) is a chemical compound with molecular formula C16H25ClO and molecular weight 268.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4,6-bis(2-methylbutan-2-yl)phenol
Also Known As: 2-Chloro-4,6-di-tert-amylphenol, 2-chloro-4,6-bis(2-methylbutan-2-yl)phenol, 2-Chloro-4,6-bis(1,1-dimethylpropyl)phenol, Phenol, 2-chloro-4,6-bis(1,1-dimethylpropyl)-, RefChem:258649
| Molecular Formula | C16H25ClO |
|---|---|
| Molecular Weight | 268.16 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.1594 |
| Heavy Atoms | 18 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 42350-99-2 |
|---|---|
| SMILES | CCC(C)(C)C1=CC(=C(C(=C1)Cl)O)C(C)(C)CC |
| InChIKey | LWNGLBUFFUWWBH-UHFFFAOYSA-N |
Product Overview
2-Chloro-4,6-di-tert-amylphenol (CAS 42350-99-2), with molecular formula C16H25ClO and molecular weight 268.16 g/mol. IUPAC: 2-chloro-4,6-bis(2-methylbutan-2-yl)phenol.
Chemical Property Profile of 2-Chloro-4,6-di-tert-amylphenol
Property Insights of 2-Chloro-4,6-di-tert-amylphenol
The XLogP value of 6.6 indicates that 2-Chloro-4,6-di-tert-amylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Chloro-4,6-di-tert-amylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4,6-di-tert-amylphenol 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 2-Chloro-4,6-di-tert-amylphenol?
The CAS number of 2-Chloro-4,6-di-tert-amylphenol is 42350-99-2.
What is the molecular formula of 2-Chloro-4,6-di-tert-amylphenol?
The molecular formula of 2-Chloro-4,6-di-tert-amylphenol is C16H25ClO.
What is the molecular weight of 2-Chloro-4,6-di-tert-amylphenol?
The molecular weight of 2-Chloro-4,6-di-tert-amylphenol is 268.16 g/mol.
Where can I buy 2-Chloro-4,6-di-tert-amylphenol?
You can request a quote for 2-Chloro-4,6-di-tert-amylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4,6-di-tert-amylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4,6-di-tert-amylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.