Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate
TL;DR: Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate (CAS 24508-01-8) is a chemical compound with molecular formula C20H24O3 and molecular weight 312.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(17-hydroxy-13-methyl-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-yl) acetate
Also Known As: Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate, 17-hydroxyestra-1,3,5(10),7-tetraen-3-yl acetate, 17-Hydroxyestra-1(10),2,4,7-tetraen-3-yl acetate, estra-1,3,5(10),7-tetraene-3,17, A-diol 3-acetate
| Molecular Formula | C20H24O3 |
|---|---|
| Molecular Weight | 312.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.17255 |
| Heavy Atoms | 23 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 24508-01-8 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C=C1)C3CCC4(C(C3=CC2)CCC4O)C |
| InChIKey | RVWUTTUZKJOUDV-UHFFFAOYSA-N |
Product Overview
Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate (CAS 24508-01-8), with molecular formula C20H24O3 and molecular weight 312.17 g/mol. IUPAC: (17-hydroxy-13-methyl-6,9,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-3-yl) acetate.
Chemical Property Profile of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate
Property Insights of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate
The XLogP value of 3.3 indicates that Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate 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 Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate?
The CAS number of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate is 24508-01-8.
What is the molecular formula of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate?
The molecular formula of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate is C20H24O3.
What is the molecular weight of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate?
The molecular weight of Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate is 312.17 g/mol.
Where can I buy Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate?
You can request a quote for Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate?
Yes, KEHONG BIO provides custom synthesis services for Estra-1,3,5(10),7-tetraene-3,17beta-diol 3-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.