alpha-Estradiol, dimethyl ether
TL;DR: alpha-Estradiol, dimethyl ether (CAS 4954-14-7) is a chemical compound with molecular formula C20H28O2 and molecular weight 300.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,17-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene
Also Known As: Ethyl malonate monoamide, .alpha.-Estradiol, dimethyl ether, 3,17-Dimethoxyestra-1,3,5(10)-triene, 3,17-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene
| Molecular Formula | C20H28O2 |
|---|---|
| Molecular Weight | 300.21 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.20892 |
| Heavy Atoms | 22 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 4954-14-7 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2OC)CCC4=C3C=CC(=C4)OC |
| InChIKey | UJVDXOJUUSHVJY-UHFFFAOYSA-N |
Product Overview
alpha-Estradiol, dimethyl ether (CAS 4954-14-7), with molecular formula C20H28O2 and molecular weight 300.21 g/mol. IUPAC: 3,17-dimethoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene.
Chemical Property Profile of alpha-Estradiol, dimethyl ether
Property Insights of alpha-Estradiol, dimethyl ether
The XLogP value of 3.6 indicates that alpha-Estradiol, dimethyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, alpha-Estradiol, dimethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Estradiol, dimethyl ether has 0 hydrogen bond donor(s) and 2 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 alpha-Estradiol, dimethyl ether?
The CAS number of alpha-Estradiol, dimethyl ether is 4954-14-7.
What is the molecular formula of alpha-Estradiol, dimethyl ether?
The molecular formula of alpha-Estradiol, dimethyl ether is C20H28O2.
What is the molecular weight of alpha-Estradiol, dimethyl ether?
The molecular weight of alpha-Estradiol, dimethyl ether is 300.21 g/mol.
Where can I buy alpha-Estradiol, dimethyl ether?
You can request a quote for alpha-Estradiol, dimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Estradiol, dimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for alpha-Estradiol, dimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.