(E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol
TL;DR: (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol (CAS 52691-43-7) is a chemical compound with molecular formula C18H28O3 and molecular weight 292.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-8-(4-ethylphenoxy)-2,6-dimethyloct-6-ene-2,3-diol
Also Known As: (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol, 6-Octene-2,3-diol, 8-(4-ethylphenoxy)-2,6-dimethyl-, (E)-, (E)-8-(4-ethylphenoxy)-2,6-dimethyloct-6-ene-2,3-diol
| Molecular Formula | C18H28O3 |
|---|---|
| Molecular Weight | 292.20 g/mol |
| LogP | 3.4861 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 292.20386 |
| Heavy Atoms | 21 |
| Complexity | 440.5264 |
Chemical Identifiers
| CAS Number | 52691-43-7 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OC/C=C(\C)/CCC(C(C)(C)O)O |
Product Overview
(E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol (CAS 52691-43-7), with molecular formula C18H28O3 and molecular weight 292.20 g/mol. IUPAC: (E)-8-(4-ethylphenoxy)-2,6-dimethyloct-6-ene-2,3-diol.
Chemical Property Profile of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol
Property Insights of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol
The XLogP value of 3.4861 indicates that (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.69 Ų, (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol has 2 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 (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol?
The CAS number of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol is 52691-43-7.
What is the molecular formula of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol?
The molecular formula of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol is C18H28O3.
What is the molecular weight of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol?
The molecular weight of (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol is 292.20 g/mol.
Where can I buy (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol?
You can request a quote for (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol?
Yes, KEHONG BIO provides custom synthesis services for (E)-8-(4-Ethylphenoxy)-2,6-dimethyl-6-octene-2,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.