(2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone
TL;DR: (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone (CAS 578747-38-3) is a chemical compound with molecular formula C17H17F3O4 and molecular weight 342.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3Z)-3-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-hydroxycyclohexen-1-yl]-2,2,2-trifluoroethanone
Also Known As: (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone, 1-[(3Z)-3-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-hydroxycyclohexen-1-yl]-2,2,2-trifluoroethanone
| Molecular Formula | C17H17F3O4 |
|---|---|
| Molecular Weight | 342.11 g/mol |
| LogP | 4.3017 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 342.10788 |
| Heavy Atoms | 24 |
| Complexity | 702.27747 |
Chemical Identifiers
| CAS Number | 578747-38-3 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/CCCC(=C2O)C(=O)C(F)(F)F)O |
Product Overview
(2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone (CAS 578747-38-3), with molecular formula C17H17F3O4 and molecular weight 342.11 g/mol. IUPAC: 1-[(3Z)-3-[(3-ethoxy-4-hydroxyphenyl)methylidene]-2-hydroxycyclohexen-1-yl]-2,2,2-trifluoroethanone.
Chemical Property Profile of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone
Property Insights of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone
The XLogP value of 4.3017 indicates that (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone. Following Lipinski's Rule of Five, (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone has 2 hydrogen bond donor(s) and 4 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 (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone?
The CAS number of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone is 578747-38-3.
What is the molecular formula of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone?
The molecular formula of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone is C17H17F3O4.
What is the molecular weight of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone?
The molecular weight of (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone is 342.11 g/mol.
Where can I buy (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone?
You can request a quote for (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone?
Yes, KEHONG BIO provides custom synthesis services for (2Z,6Z)-2-(3-ethoxy-4-hydroxybenzylidene)-6-(2,2,2-trifluoro-1-hydroxyethylidene)cyclohexanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.