4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol
TL;DR: 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol (CAS 71113-07-0) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]benzene-1,2-diol
Also Known As: Hydroxydiethylstilbestrol, E-3'-Hydroxydiethylstilbestrol, 3,4,4'-Trihydroxy-alpha,alpha'-diethylstilbene, 3,4,4'-TDTS, alpha,alpha'-Diethyl-3,4,4'-stilbenetriol
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 4.5342 |
| Topological Polar Surface Area | 60.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 654.6637 |
Chemical Identifiers
| CAS Number | 71113-07-0 |
|---|---|
| SMILES | CC/C(=C(/CC)\C1=CC(=C(C=C1)O)O)/C2=CC=C(C=C2)O |
Product Overview
4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol (CAS 71113-07-0), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: 4-[(E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]benzene-1,2-diol.
Chemical Property Profile of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol
Property Insights of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol
The XLogP value of 4.5342 indicates that 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol. Following Lipinski's Rule of Five, 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol has 3 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-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol?
The CAS number of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol is 71113-07-0.
What is the molecular formula of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol?
The molecular formula of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol is C18H20O3.
What is the molecular weight of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol?
The molecular weight of 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol is 284.14 g/mol.
Where can I buy 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol?
You can request a quote for 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol?
Yes, KEHONG BIO provides custom synthesis services for 4-((1E)-1-Ethyl-2-(4-hydroxyphenyl)-1-buten-1-yl)-1,2-benzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.