Dimethyl sebacate
TL;DR: Dimethyl sebacate (CAS 106-79-6) is a chemical compound with molecular formula C12H22O4 and molecular weight 230.15181 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl decanedioate
Also Known As: Dimethyl decanedioate, DIMETHYL SEBACATE, Methyl sebacate, Sebacic acid dimethyl ester, Decanedioic acid, dimethyl ester
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H22O4 |
| Molecular Weight | 230.15181 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 230.15181 Da |
| Heavy Atoms | 16 |
| Complexity | 179.0 |
| SMILES | COC(=O)CCCCCCCCC(=O)OC |
| InChIKey | ALOUNLDAKADEEB-UHFFFAOYSA-N |
Product Description
Applications: Dimethyl sebacate is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dimethyl sebacate (CAS 106-79-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Dimethyl sebacate (CAS 106-79-6) is a pharmaceutical intermediate with the molecular formula C12H22O4 and a molecular weight of 230.15 g/mol. It is also known as Dimethyl decanedioate and DIMETHYL SEBACATE.
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 Dimethyl sebacate
Property Insights of Dimethyl sebacate
The XLogP value of 3.0 indicates that Dimethyl sebacate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, Dimethyl sebacate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl sebacate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Dimethyl sebacate?
The CAS number of Dimethyl sebacate is 106-79-6.
What is the molecular formula of Dimethyl sebacate?
The molecular formula of Dimethyl sebacate is C12H22O4.
What is the molecular weight of Dimethyl sebacate?
The molecular weight of Dimethyl sebacate is 230.15181 g/mol.
What are the applications of Dimethyl sebacate?
Dimethyl sebacate is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dimethyl sebacate (CAS 106-79-6) with custom synthesis...
Where can I buy Dimethyl sebacate?
You can request a quote for Dimethyl sebacate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dimethyl sebacate?
Yes, CoreyChem provides custom synthesis services for Dimethyl sebacate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.