Methyl behenate
TL;DR: Methyl behenate (CAS 929-77-1) is a chemical compound with molecular formula C23H46O2 and molecular weight 354.3498 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
山萮酸甲酯
methyl docosanoate
Also Known As: Methyl behenate, Methyl docosanoate, Behenic acid methyl ester, Docosanoic acid, methyl ester, Docosanoic acid methyl ester
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C23H46O2 |
| Molecular Weight | 354.3498 g/mol |
| XLogP | 11.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 354.3498 Da |
| Heavy Atoms | 25 |
| Complexity | 263.0 |
| Melting Point | 54 °C |
| Boiling Point | 224-225 °C @ 15 MM HG |
| Vapor Pressure | 0.0000013 [mmHg] |
| Refractive Index | INDEX OF REFRACTION: 1.4339 @ 60 °C/D |
| Solubility | INSOL IN WATER; SOL IN ALCOHOL, ETHER |
| SMILES | CCCCCCCCCCCCCCCCCCCCCC(=O)OC |
| InChIKey | QSQLTHHMFHEFIY-UHFFFAOYSA-N |
Product Description
Applications: Methyl behenate is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. 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).
Methyl behenate is a pharmaceutical intermediate identified by CAS number 929-77-1 and the molecular formula C23H46O2 and a molecular weight of 354.35 g/mol. Physically, the compound has a solubility: INSOL IN WATER; SOL IN ALCOHOL, ETHER. Synonyms include Methyl behenate and Methyl docosanoate.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methyl behenate
Property Insights of Methyl behenate
The XLogP value of 11.2 indicates that Methyl behenate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl behenate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl behenate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Methyl behenate?
The CAS number of Methyl behenate is 929-77-1.
What is the molecular formula of Methyl behenate?
The molecular formula of Methyl behenate is C23H46O2.
What is the molecular weight of Methyl behenate?
The molecular weight of Methyl behenate is 354.3498 g/mol.
What are the applications of Methyl behenate?
Methyl behenate is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. 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),...
Where can I buy Methyl behenate?
You can request a quote for Methyl behenate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl behenate?
Yes, CoreyChem provides custom synthesis services for Methyl behenate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.