Methyl 3-methoxyprop-2-enoate
TL;DR: Methyl 3-methoxyprop-2-enoate (CAS 15952-61-1) is a chemical compound with molecular formula C5H8O3 and molecular weight 116.04734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-methoxyprop-2-enoate
Also Known As: Methyl 3-Methoxyacrylate, 6-Chloropiperonal, Methyl-3-methoxyacrylate, methyl 3-methoxyprop-2-enoate, Methyl trans-3-methoxyacrylate
Technical Specifications
| Molecular Formula | C5H8O3 |
| Molecular Weight | 116.04734 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 116.04734 Da |
| Heavy Atoms | 8 |
| Complexity | 95.0 |
| SMILES | COC=CC(=O)OC |
| InChIKey | AUTCCPQKLPMHDN-UHFFFAOYSA-N |
Chemical Property Profile of Methyl 3-methoxyprop-2-enoate
Property Insights of Methyl 3-methoxyprop-2-enoate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methoxyprop-2-enoate. With a topological polar surface area (TPSA) of 35.5 Ų, Methyl 3-methoxyprop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-methoxyprop-2-enoate 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 Methyl 3-methoxyprop-2-enoate?
The CAS number of Methyl 3-methoxyprop-2-enoate is 15952-61-1.
What is the molecular formula of Methyl 3-methoxyprop-2-enoate?
The molecular formula of Methyl 3-methoxyprop-2-enoate is C5H8O3.
What is the molecular weight of Methyl 3-methoxyprop-2-enoate?
The molecular weight of Methyl 3-methoxyprop-2-enoate is 116.04734 g/mol.
Where can I buy Methyl 3-methoxyprop-2-enoate?
You can request a quote for Methyl 3-methoxyprop-2-enoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl 3-methoxyprop-2-enoate?
Yes, CoreyChem provides custom synthesis services for Methyl 3-methoxyprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.