2-Tert-butyl-4-octylphenol
TL;DR: 2-Tert-butyl-4-octylphenol (CAS 61899-80-7) is a chemical compound with molecular formula C18H30O and molecular weight 262.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-4-octylphenol
Also Known As: 2-TERT-BUTYL-4-OCTYLPHENOL, 4-octyl-2-tert-butyl-phenol, Phenol, 2-(1,1-dimethylethyl)-4-octyl-
| Molecular Formula | C18H30O |
|---|---|
| Molecular Weight | 262.23 g/mol |
| LogP | 5.5927 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.22968 |
| Heavy Atoms | 19 |
| Complexity | 373.76694 |
Chemical Identifiers
| CAS Number | 61899-80-7 |
|---|---|
| SMILES | CCCCCCCCC1=CC(=C(C=C1)O)C(C)(C)C |
Product Overview
2-Tert-butyl-4-octylphenol (CAS 61899-80-7), with molecular formula C18H30O and molecular weight 262.23 g/mol. IUPAC: 2-tert-butyl-4-octylphenol.
Chemical Property Profile of 2-Tert-butyl-4-octylphenol
Property Insights of 2-Tert-butyl-4-octylphenol
The XLogP value of 5.5927 indicates that 2-Tert-butyl-4-octylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 2-Tert-butyl-4-octylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-4-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-Tert-butyl-4-octylphenol?
The CAS number of 2-Tert-butyl-4-octylphenol is 61899-80-7.
What is the molecular formula of 2-Tert-butyl-4-octylphenol?
The molecular formula of 2-Tert-butyl-4-octylphenol is C18H30O.
What is the molecular weight of 2-Tert-butyl-4-octylphenol?
The molecular weight of 2-Tert-butyl-4-octylphenol is 262.23 g/mol.
Where can I buy 2-Tert-butyl-4-octylphenol?
You can request a quote for 2-Tert-butyl-4-octylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tert-butyl-4-octylphenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-4-octylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.