3,17I(2)-Estradiol-3-methylether-17-decanoate
TL;DR: 3,17I(2)-Estradiol-3-methylether-17-decanoate (CAS 1042947-85-2) is a chemical compound with molecular formula C29H44O3 and molecular weight 440.33 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]phenanthren-17-yl) decanoate
Also Known As: 3,17I(2)-Estradiol-3-methylether-17-decanoate, (3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) Decanoate
| Molecular Formula | C29H44O3 |
|---|---|
| Molecular Weight | 440.33 g/mol |
| LogP | 7.6038 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 440.32904 |
| Heavy Atoms | 32 |
| Complexity | 771.6655 |
Chemical Identifiers
| CAS Number | 1042947-85-2 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OC1CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC)C |
Product Overview
3,17I(2)-Estradiol-3-methylether-17-decanoate (CAS 1042947-85-2), with molecular formula C29H44O3 and molecular weight 440.33 g/mol. IUPAC: (3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl) decanoate.
Chemical Property Profile of 3,17I(2)-Estradiol-3-methylether-17-decanoate
Property Insights of 3,17I(2)-Estradiol-3-methylether-17-decanoate
The XLogP value of 7.6038 indicates that 3,17I(2)-Estradiol-3-methylether-17-decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 3,17I(2)-Estradiol-3-methylether-17-decanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,17I(2)-Estradiol-3-methylether-17-decanoate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,17I(2)-Estradiol-3-methylether-17-decanoate?
The CAS number of 3,17I(2)-Estradiol-3-methylether-17-decanoate is 1042947-85-2.
What is the molecular formula of 3,17I(2)-Estradiol-3-methylether-17-decanoate?
The molecular formula of 3,17I(2)-Estradiol-3-methylether-17-decanoate is C29H44O3.
What is the molecular weight of 3,17I(2)-Estradiol-3-methylether-17-decanoate?
The molecular weight of 3,17I(2)-Estradiol-3-methylether-17-decanoate is 440.33 g/mol.
Where can I buy 3,17I(2)-Estradiol-3-methylether-17-decanoate?
You can request a quote for 3,17I(2)-Estradiol-3-methylether-17-decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,17I(2)-Estradiol-3-methylether-17-decanoate?
Yes, KEHONG BIO provides custom synthesis services for 3,17I(2)-Estradiol-3-methylether-17-decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.