methyl (E)-3-acetyloxyprop-2-enoate
TL;DR: methyl (E)-3-acetyloxyprop-2-enoate (CAS 5449-58-1) is a chemical compound with molecular formula C6H8O4 and molecular weight 144.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-acetyloxyprop-2-enoate
Also Known As: Methyl 3-acetoxyacrylate, methyl 3-(acetyloxy)prop-2-enoate, 3-acetoxyacrylic acid methyl ester, EINECS 258-652-9, methyl (E)-3-acetyloxyprop-2-enoate
| Molecular Formula | C6H8O4 |
|---|---|
| Molecular Weight | 144.04 g/mol |
| LogP | 0.2362 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 144.04225 |
| Heavy Atoms | 10 |
| Complexity | 159.13075 |
Chemical Identifiers
| CAS Number | 5449-58-1 |
|---|---|
| SMILES | CC(=O)O/C=C/C(=O)OC |
Product Overview
methyl (E)-3-acetyloxyprop-2-enoate (CAS 5449-58-1), with molecular formula C6H8O4 and molecular weight 144.04 g/mol. IUPAC: methyl (E)-3-acetyloxyprop-2-enoate.
Chemical Property Profile of methyl (E)-3-acetyloxyprop-2-enoate
Property Insights of methyl (E)-3-acetyloxyprop-2-enoate
The XLogP value of 0.2362 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (E)-3-acetyloxyprop-2-enoate. With a topological polar surface area (TPSA) of 52.6 Ų, methyl (E)-3-acetyloxyprop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (E)-3-acetyloxyprop-2-enoate 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
Frequently Asked Questions
What is the CAS number of methyl (E)-3-acetyloxyprop-2-enoate?
The CAS number of methyl (E)-3-acetyloxyprop-2-enoate is 5449-58-1.
What is the molecular formula of methyl (E)-3-acetyloxyprop-2-enoate?
The molecular formula of methyl (E)-3-acetyloxyprop-2-enoate is C6H8O4.
What is the molecular weight of methyl (E)-3-acetyloxyprop-2-enoate?
The molecular weight of methyl (E)-3-acetyloxyprop-2-enoate is 144.04 g/mol.
Where can I buy methyl (E)-3-acetyloxyprop-2-enoate?
You can request a quote for methyl (E)-3-acetyloxyprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl (E)-3-acetyloxyprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl (E)-3-acetyloxyprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.