Methallenestril
TL;DR: Methallenestril (CAS 517-18-0) is a chemical compound with molecular formula C18H22O3 and molecular weight 286.1569 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpentanoic acid
Also Known As: METHALLENESTRIL, Methallenestrol, Vallestril, Novestrine, Ercostrol
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22O3 |
| Molecular Weight | 286.1569 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.1569 Da |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
| Melting Point | 139-140 °C |
| Solubility | SOL IN ETHER & VEGETABLE OILS; INSOL IN WATER; FREELY SOL IN CHLOROFORM |
| SMILES | CCC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(C)(C)C(=O)O |
| InChIKey | KHLJKRBMZVNZOC-UHFFFAOYSA-N |
Product Description
Applications: Methallenestril is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. 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).
Methallenestril is a pharmaceutical intermediate identified by CAS number 517-18-0 and the molecular formula C18H22O3 and a molecular weight of 286.16 g/mol. Physically, the compound has a solubility: SOL IN ETHER & VEGETABLE OILS; INSOL IN WATER; FREELY SOL IN CHLOROFORM. Synonyms include METHALLENESTRIL and Methallenestrol.
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 Methallenestril
Property Insights of Methallenestril
The XLogP value of 4.7 indicates that Methallenestril is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Methallenestril exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methallenestril has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Methallenestril?
The CAS number of Methallenestril is 517-18-0.
What is the molecular formula of Methallenestril?
The molecular formula of Methallenestril is C18H22O3.
What is the molecular weight of Methallenestril?
The molecular weight of Methallenestril is 286.1569 g/mol.
What are the applications of Methallenestril?
Methallenestril is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Methallenestril?
You can request a quote for Methallenestril directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methallenestril?
Yes, CoreyChem provides custom synthesis services for Methallenestril and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.