2-Methyl-4-tert-octylphenol
TL;DR: 2-Methyl-4-tert-octylphenol (CAS 2219-84-3) is a chemical compound with molecular formula C15H24O and molecular weight 220.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenol
Also Known As: 2-Methyl-4-tert-octylphenol, 4-tert-Octyl-o-cresol, Phenol, 2-methyl-4-(1,1,3,3-tetramethylbutyl)-, 4-tert-Octyl-o-cresol (kent to verify), 2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenol
| Molecular Formula | C15H24O |
|---|---|
| Molecular Weight | 220.18 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 220.18271 |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 2219-84-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(C)(C)CC(C)(C)C)O |
| InChIKey | DYKCNMUCTREDMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methyl-4-tert-octylphenol (CAS 2219-84-3), with molecular formula C15H24O and molecular weight 220.18 g/mol. IUPAC: 2-methyl-4-(2,4,4-trimethylpentan-2-yl)phenol.
Chemical Property Profile of 2-Methyl-4-tert-octylphenol
Property Insights of 2-Methyl-4-tert-octylphenol
The XLogP value of 5.3 indicates that 2-Methyl-4-tert-octylphenol 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-Methyl-4-tert-octylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-tert-octylphenol 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-Methyl-4-tert-octylphenol?
The CAS number of 2-Methyl-4-tert-octylphenol is 2219-84-3.
What is the molecular formula of 2-Methyl-4-tert-octylphenol?
The molecular formula of 2-Methyl-4-tert-octylphenol is C15H24O.
What is the molecular weight of 2-Methyl-4-tert-octylphenol?
The molecular weight of 2-Methyl-4-tert-octylphenol is 220.18 g/mol.
Where can I buy 2-Methyl-4-tert-octylphenol?
You can request a quote for 2-Methyl-4-tert-octylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-4-tert-octylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-4-tert-octylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.