4-tert-Octylphenol Diethoxylate
TL;DR: 4-tert-Octylphenol Diethoxylate (CAS 2315-61-9) is a chemical compound with molecular formula C18H30O3 and molecular weight 294.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethanol
Also Known As: 4-tert-Octylphenol Diethoxylate, Hydrol, Emulsifier OP, Synperonic OP, Alkasurf OP
| Molecular Formula | C18H30O3 |
|---|---|
| Molecular Weight | 294.22 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.21948 |
| Heavy Atoms | 21 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 2315-61-9 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCOCCO |
| InChIKey | LBCZOTMMGHGTPH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-tert-Octylphenol Diethoxylate (CAS 2315-61-9), with molecular formula C18H30O3 and molecular weight 294.22 g/mol. IUPAC: 2-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethoxy]ethanol.
Chemical Property Profile of 4-tert-Octylphenol Diethoxylate
Property Insights of 4-tert-Octylphenol Diethoxylate
The XLogP value of 4.5 indicates that 4-tert-Octylphenol Diethoxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 4-tert-Octylphenol Diethoxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-Octylphenol Diethoxylate has 1 hydrogen bond donor(s) and 3 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-Octylphenol Diethoxylate?
The CAS number of 4-tert-Octylphenol Diethoxylate is 2315-61-9.
What is the molecular formula of 4-tert-Octylphenol Diethoxylate?
The molecular formula of 4-tert-Octylphenol Diethoxylate is C18H30O3.
What is the molecular weight of 4-tert-Octylphenol Diethoxylate?
The molecular weight of 4-tert-Octylphenol Diethoxylate is 294.22 g/mol.
Where can I buy 4-tert-Octylphenol Diethoxylate?
You can request a quote for 4-tert-Octylphenol Diethoxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-Octylphenol Diethoxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-Octylphenol Diethoxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.