Etiocholanolone
TL;DR: Etiocholanolone (CAS 53-42-9) is a chemical compound with molecular formula C19H30O2 and molecular weight 290.22458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,5R,8R,9S,10S,13S,14S)-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
Also Known As: etiocholanolone, 5-Isoandrosterone, Aetiocholanolone, 5beta-Androsterone, 5b-androsterone
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C19H30O2 |
| Molecular Weight | 290.22458 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 290.22458 Da |
| Heavy Atoms | 21 |
| Complexity | 458.0 |
| Melting Point | 152 - 154 °C |
| SMILES | C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O |
| InChIKey | QGXBDMJGAMFCBF-BNSUEQOYSA-N |
Product Description
Applications: Etiocholanolone is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Etiocholanolone is a pharmaceutical intermediate identified by CAS number 53-42-9 and the molecular formula C19H30O2 and a molecular weight of 290.22 g/mol. Synonyms include etiocholanolone and 5-Isoandrosterone.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Etiocholanolone
Property Insights of Etiocholanolone
The XLogP value of 3.7 indicates that Etiocholanolone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Etiocholanolone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etiocholanolone has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Etiocholanolone?
The CAS number of Etiocholanolone is 53-42-9.
What is the molecular formula of Etiocholanolone?
The molecular formula of Etiocholanolone is C19H30O2.
What is the molecular weight of Etiocholanolone?
The molecular weight of Etiocholanolone is 290.22458 g/mol.
What are the applications of Etiocholanolone?
Etiocholanolone is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Etiocholanolone?
You can request a quote for Etiocholanolone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Etiocholanolone?
Yes, CoreyChem provides custom synthesis services for Etiocholanolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.