Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate
TL;DR: Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate (CAS 155335-56-1) is a chemical compound with molecular formula C11H16O4 and molecular weight 212.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate
Also Known As: Methyl 7-oxo-2-octynoate ethylene ketal, Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate
Technical Specifications
| Molecular Formula | C11H16O4 |
| Molecular Weight | 212.10486 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.10486 Da |
| Heavy Atoms | 15 |
| Complexity | 277.0 |
| SMILES | CC1(OCCO1)CCCC#CC(=O)OC |
| InChIKey | WRMIMLBOHZHMEN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate
Property Insights of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate 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 Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate?
The CAS number of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate is 155335-56-1.
What is the molecular formula of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate?
The molecular formula of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate is C11H16O4.
What is the molecular weight of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate?
The molecular weight of Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate is 212.10486 g/mol.
Where can I buy Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate?
You can request a quote for Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate?
Yes, CoreyChem provides custom synthesis services for Methyl 6-(2-methyl-1,3-dioxolan-2-yl)hex-2-ynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.