Ketohydroxy-Estratriene
TL;DR: Ketohydroxy-Estratriene (CAS 53-16-7) is a chemical compound with molecular formula C18H22O2 and molecular weight 270.162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Also Known As: estrone, folliculin, Unden, estrol, estrovarin
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22O2 |
| Molecular Weight | 270.162 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 270.162 Da |
| Heavy Atoms | 20 |
| Complexity | 418.0 |
| SMILES | CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)O |
| InChIKey | DNXHEGUUPJUMQT-UHFFFAOYSA-N |
Product Description
Applications: Ketohydroxy-Estratriene is used in agrochemical development, including crop protection agent synthesis, as well as biotechnology workflows and life-science research. 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).
Ketohydroxy-Estratriene is a agrochemical intermediate identified by CAS number 53-16-7 and the molecular formula C18H22O2 and a molecular weight of 270.16 g/mol. Synonyms include estrone and folliculin.
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 Ketohydroxy-Estratriene
Property Insights of Ketohydroxy-Estratriene
The XLogP value of 3.1 indicates that Ketohydroxy-Estratriene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Ketohydroxy-Estratriene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ketohydroxy-Estratriene 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 Ketohydroxy-Estratriene?
The CAS number of Ketohydroxy-Estratriene is 53-16-7.
What is the molecular formula of Ketohydroxy-Estratriene?
The molecular formula of Ketohydroxy-Estratriene is C18H22O2.
What is the molecular weight of Ketohydroxy-Estratriene?
The molecular weight of Ketohydroxy-Estratriene is 270.162 g/mol.
What are the applications of Ketohydroxy-Estratriene?
Ketohydroxy-Estratriene is used in agrochemical development, including crop protection agent synthesis, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Ketohydroxy-Estratriene?
You can request a quote for Ketohydroxy-Estratriene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ketohydroxy-Estratriene?
Yes, CoreyChem provides custom synthesis services for Ketohydroxy-Estratriene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.