Methyl 4-(oxan-2-yloxy)pent-2-ynoate
TL;DR: Methyl 4-(oxan-2-yloxy)pent-2-ynoate (CAS 116315-80-1) 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 4-(oxan-2-yloxy)pent-2-ynoate
Also Known As: Benzenesulfonamide,2,3-dihydroxy, Methyl 4-(oxan-2-yloxy)pent-2-ynoate, (S)-4-(Tetrahydro-pyran-2-yloxy)-pent-2-ynoic acid methyl ester, 2-Pentynoic acid, 4-[(tetrahydro-2H-pyran-2-yl)oxy]-, methyl ester, (4S)-
Technical Specifications
| Molecular Formula | C11H16O4 |
| Molecular Weight | 212.10486 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 212.10486 Da |
| Heavy Atoms | 15 |
| Complexity | 273.0 |
| SMILES | CC(C#CC(=O)OC)OC1CCCCO1 |
| InChIKey | MPUVFUVDEJMNFU-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 4-(oxan-2-yloxy)pent-2-ynoate
Property Insights of Methyl 4-(oxan-2-yloxy)pent-2-ynoate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(oxan-2-yloxy)pent-2-ynoate. With a topological polar surface area (TPSA) of 44.8 Ų, Methyl 4-(oxan-2-yloxy)pent-2-ynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-(oxan-2-yloxy)pent-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 4-(oxan-2-yloxy)pent-2-ynoate?
The CAS number of Methyl 4-(oxan-2-yloxy)pent-2-ynoate is 116315-80-1.
What is the molecular formula of Methyl 4-(oxan-2-yloxy)pent-2-ynoate?
The molecular formula of Methyl 4-(oxan-2-yloxy)pent-2-ynoate is C11H16O4.
What is the molecular weight of Methyl 4-(oxan-2-yloxy)pent-2-ynoate?
The molecular weight of Methyl 4-(oxan-2-yloxy)pent-2-ynoate is 212.10486 g/mol.
Where can I buy Methyl 4-(oxan-2-yloxy)pent-2-ynoate?
You can request a quote for Methyl 4-(oxan-2-yloxy)pent-2-ynoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 4-(oxan-2-yloxy)pent-2-ynoate?
Yes, CoreyChem provides custom synthesis services for Methyl 4-(oxan-2-yloxy)pent-2-ynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.