3-O-Methyl 6-Hydroxy 17b-Estradiol
TL;DR: 3-O-Methyl 6-Hydroxy 17b-Estradiol (CAS 109835-83-8) is a chemical compound with molecular formula C19H26O3 and molecular weight 302.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-6,17-diol
Also Known As: 3-O-Methyl 6-Hydroxy 17b-Estradiol, 3-Methoxyestra-1,3,5(10)-triene-6,17-diol, (17beta)-3-Methoxyestra-1,3,5(10)-triene-6,17-diol, (8R,9S,13S,14S,17S)-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-6,17-diol, 3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-6,17-diol
| Molecular Formula | C19H26O3 |
|---|---|
| Molecular Weight | 302.19 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 302.1882 |
| Heavy Atoms | 22 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 109835-83-8 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2O)CC(C4=C3C=CC(=C4)OC)O |
| InChIKey | SGKSNEXYMMIQKE-UHFFFAOYSA-N |
Product Overview
3-O-Methyl 6-Hydroxy 17b-Estradiol (CAS 109835-83-8), with molecular formula C19H26O3 and molecular weight 302.19 g/mol. IUPAC: 3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-6,17-diol.
Chemical Property Profile of 3-O-Methyl 6-Hydroxy 17b-Estradiol
Property Insights of 3-O-Methyl 6-Hydroxy 17b-Estradiol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-O-Methyl 6-Hydroxy 17b-Estradiol. With a topological polar surface area (TPSA) of 49.7 Ų, 3-O-Methyl 6-Hydroxy 17b-Estradiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-O-Methyl 6-Hydroxy 17b-Estradiol has 2 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 3-O-Methyl 6-Hydroxy 17b-Estradiol?
The CAS number of 3-O-Methyl 6-Hydroxy 17b-Estradiol is 109835-83-8.
What is the molecular formula of 3-O-Methyl 6-Hydroxy 17b-Estradiol?
The molecular formula of 3-O-Methyl 6-Hydroxy 17b-Estradiol is C19H26O3.
What is the molecular weight of 3-O-Methyl 6-Hydroxy 17b-Estradiol?
The molecular weight of 3-O-Methyl 6-Hydroxy 17b-Estradiol is 302.19 g/mol.
Where can I buy 3-O-Methyl 6-Hydroxy 17b-Estradiol?
You can request a quote for 3-O-Methyl 6-Hydroxy 17b-Estradiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-O-Methyl 6-Hydroxy 17b-Estradiol?
Yes, KEHONG BIO provides custom synthesis services for 3-O-Methyl 6-Hydroxy 17b-Estradiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.