庚酸雌二醇
TL;DR: 庚酸雌二醇 (CAS 4956-37-0) is a chemical compound with molecular formula C25H36O3 and molecular weight 384.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
庚酸雌二醇
[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] heptanoate
Also Known As: ESTRADIOL ENANTHATE, Oestradiol 17-heptanoate, Estradiol Enantate, estradiol, Estradiol 17-heptanoate
| Molecular Formula | C25H36O3 |
|---|---|
| Molecular Weight | 384.27 g/mol |
| LogP | 7.0 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 384.26645 |
| Heavy Atoms | 28 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 4956-37-0 |
|---|---|
| SMILES | CCCCCCC(=O)O[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=C3C=CC(=C4)O)C |
| InChIKey | RFWTZQAOOLFXAY-BZDYCCQFSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
庚酸雌二醇 (CAS 4956-37-0), with molecular formula C25H36O3 and molecular weight 384.27 g/mol. IUPAC: [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] heptanoate.
Chemical Property Profile of 庚酸雌二醇
Property Insights of 庚酸雌二醇
The XLogP value of 7.0 indicates that 庚酸雌二醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 庚酸雌二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 庚酸雌二醇 has 1 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 庚酸雌二醇?
The CAS number of 庚酸雌二醇 is 4956-37-0.
What is the molecular formula of 庚酸雌二醇?
The molecular formula of 庚酸雌二醇 is C25H36O3.
What is the molecular weight of 庚酸雌二醇?
The molecular weight of 庚酸雌二醇 is 384.27 g/mol.
Where can I buy 庚酸雌二醇?
You can request a quote for 庚酸雌二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 庚酸雌二醇?
Yes, KEHONG BIO provides custom synthesis services for 庚酸雌二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.