己烷雌酚
TL;DR: 己烷雌酚 (CAS 5635-50-7) is a chemical compound with molecular formula C18H22O2 and molecular weight 270.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
己烷雌酚
4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol
Also Known As: hexestrol, Vitestrol, Dihydrodiethylstilbestrol, Hexoestrolum, Cycloestrol
| Molecular Formula | C18H22O2 |
|---|---|
| Molecular Weight | 270.16 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.162 |
| Heavy Atoms | 20 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 5635-50-7 |
|---|---|
| SMILES | CCC(C1=CC=C(C=C1)O)C(CC)C2=CC=C(C=C2)O |
| InChIKey | PBBGSZCBWVPOOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
己烷雌酚 (CAS 5635-50-7), with molecular formula C18H22O2 and molecular weight 270.16 g/mol. IUPAC: 4-[4-(4-hydroxyphenyl)hexan-3-yl]phenol.
Chemical Property Profile of 己烷雌酚
Property Insights of 己烷雌酚
The XLogP value of 5.2 indicates that Dihydrodiethylstilbestrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 己烷雌酚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dihydrodiethylstilbestrol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dihydrodiethylstilbestrol?
The CAS number of Dihydrodiethylstilbestrol is 5635-50-7.
What is the molecular formula of Dihydrodiethylstilbestrol?
The molecular formula of Dihydrodiethylstilbestrol is C18H22O2.
What is the molecular weight of Dihydrodiethylstilbestrol?
The molecular weight of Dihydrodiethylstilbestrol is 270.16 g/mol.
Where can I buy Dihydrodiethylstilbestrol?
You can request a quote for Dihydrodiethylstilbestrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrodiethylstilbestrol?
Yes, KEHONG BIO provides custom synthesis services for Dihydrodiethylstilbestrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.