Hexyl 2-methoxyacetate
TL;DR: Hexyl 2-methoxyacetate (CAS 145747-16-6) is a chemical compound with molecular formula C9H18O3 and molecular weight 174.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
hexyl 2-methoxyacetate
Also Known As: hexyl 2-methoxyacetate, Hexyl2-methoxyacetate, Hexyl methoxyacetate, Hexyl methoxyacetate #, Methoxyacetic acid, hexyl ester
Technical Specifications
| Molecular Formula | C9H18O3 |
| Molecular Weight | 174.1256 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 174.1256 Da |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
| SMILES | CCCCCCOC(=O)COC |
| InChIKey | QJGFFKKLJRHCMV-UHFFFAOYSA-N |
Chemical Property Profile of Hexyl 2-methoxyacetate
Property Insights of Hexyl 2-methoxyacetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexyl 2-methoxyacetate. With a topological polar surface area (TPSA) of 35.5 Ų, Hexyl 2-methoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexyl 2-methoxyacetate has 0 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 Hexyl 2-methoxyacetate?
The CAS number of Hexyl 2-methoxyacetate is 145747-16-6.
What is the molecular formula of Hexyl 2-methoxyacetate?
The molecular formula of Hexyl 2-methoxyacetate is C9H18O3.
What is the molecular weight of Hexyl 2-methoxyacetate?
The molecular weight of Hexyl 2-methoxyacetate is 174.1256 g/mol.
Where can I buy Hexyl 2-methoxyacetate?
You can request a quote for Hexyl 2-methoxyacetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Hexyl 2-methoxyacetate?
Yes, CoreyChem provides custom synthesis services for Hexyl 2-methoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.