Decyl 2-chloroacetate
TL;DR: Decyl 2-chloroacetate (CAS 106864-98-6) is a chemical compound with molecular formula C12H23ClO2 and molecular weight 234.13866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
decyl 2-chloroacetate
Also Known As: decyl 2-chloroacetate, Decyl chloroacetate, decyl2-chloroacetate, Decyl chloroacetate #, Acetic acid, chloro-, decyl ester
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H23ClO2 |
| Molecular Weight | 234.13866 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 234.13866 Da |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
| SMILES | CCCCCCCCCCOC(=O)CCl |
| InChIKey | WLAYVQKPZABXSY-UHFFFAOYSA-N |
Chemical Property Profile of Decyl 2-chloroacetate
Property Insights of Decyl 2-chloroacetate
The XLogP value of 5.1 indicates that Decyl 2-chloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Decyl 2-chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decyl 2-chloroacetate 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 Decyl 2-chloroacetate?
The CAS number of Decyl 2-chloroacetate is 106864-98-6.
What is the molecular formula of Decyl 2-chloroacetate?
The molecular formula of Decyl 2-chloroacetate is C12H23ClO2.
What is the molecular weight of Decyl 2-chloroacetate?
The molecular weight of Decyl 2-chloroacetate is 234.13866 g/mol.
Where can I buy Decyl 2-chloroacetate?
You can request a quote for Decyl 2-chloroacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Decyl 2-chloroacetate?
Yes, CoreyChem provides custom synthesis services for Decyl 2-chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.