2-Hydroxyestradiol 2,3-methylene ether
TL;DR: 2-Hydroxyestradiol 2,3-methylene ether (CAS 53586-37-1) is a chemical compound with molecular formula C19H24O3 and molecular weight 300.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,13R,14S,17S,18S)-18-methyl-5,7-dioxapentacyclo[11.7.0.02,10.04,8.014,18]icosa-2,4(8),9-trien-17-ol
Also Known As: 2-Hydroxyestradiol 2,3-methylene ether, methyl E-6-hydroxy-4-methyl-4-hexenoate, Estra-1,3,5(10)-trien-17-ol, 2,3-(methylenebis(oxy))-, (17beta)-, (1S,13R,14S,17S,18S)-18-methyl-5,7-dioxapentacyclo[11.7.0.02,10.04,8.014,18]icosa-2,4(8),9-trien-17-ol, (1S,3aS,3bR,10bS,12aS)-12a-Methyl-2,3,3a,3b,4,5,10b,11,12,12a-decahydro-1H,8H-cyclopenta[7,8]phenanthro[2,3-d][1,3]dioxol-1-ol
| Molecular Formula | C19H24O3 |
|---|---|
| Molecular Weight | 300.17 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 300.17255 |
| Heavy Atoms | 22 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 53586-37-1 |
|---|---|
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=CC5=C(C=C34)OCO5 |
| InChIKey | WPSQSCWYQNTKTA-SSTWWWIQSA-N |
Product Overview
2-Hydroxyestradiol 2,3-methylene ether (CAS 53586-37-1), with molecular formula C19H24O3 and molecular weight 300.17 g/mol. IUPAC: (1S,13R,14S,17S,18S)-18-methyl-5,7-dioxapentacyclo[11.7.0.02,10.04,8.014,18]icosa-2,4(8),9-trien-17-ol.
Chemical Property Profile of 2-Hydroxyestradiol 2,3-methylene ether
Property Insights of 2-Hydroxyestradiol 2,3-methylene ether
The XLogP value of 4.2 indicates that 2-Hydroxyestradiol 2,3-methylene ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 2-Hydroxyestradiol 2,3-methylene ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyestradiol 2,3-methylene ether 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 2-Hydroxyestradiol 2,3-methylene ether?
The CAS number of 2-Hydroxyestradiol 2,3-methylene ether is 53586-37-1.
What is the molecular formula of 2-Hydroxyestradiol 2,3-methylene ether?
The molecular formula of 2-Hydroxyestradiol 2,3-methylene ether is C19H24O3.
What is the molecular weight of 2-Hydroxyestradiol 2,3-methylene ether?
The molecular weight of 2-Hydroxyestradiol 2,3-methylene ether is 300.17 g/mol.
Where can I buy 2-Hydroxyestradiol 2,3-methylene ether?
You can request a quote for 2-Hydroxyestradiol 2,3-methylene ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyestradiol 2,3-methylene ether?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyestradiol 2,3-methylene ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.