Ethyl 2-methyl-1,3-dioxolane-2-propionate
TL;DR: Ethyl 2-methyl-1,3-dioxolane-2-propionate (CAS 941-43-5) is a chemical compound with molecular formula C9H16O4 and molecular weight 188.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(2-methyl-1,3-dioxolan-2-yl)propanoate
Also Known As: Ethyl 3-(2-methyl-1,3-dioxolan-2-yl)propanoate, 2-Methyl-, Ethyl levulinate ethylene ketal, 1,3-Dioxolane-2-propanoic acid, 2-methyl-, ethyl ester, Ethyl 4-Dioxolan Pentanoate
| Molecular Formula | C9H16O4 |
|---|---|
| Molecular Weight | 188.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 188.10486 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 941-43-5 |
|---|---|
| SMILES | CCOC(=O)CCC1(OCCO1)C |
| InChIKey | PLUNGZQWVYCJBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-methyl-1,3-dioxolane-2-propionate (CAS 941-43-5), with molecular formula C9H16O4 and molecular weight 188.10 g/mol. IUPAC: ethyl 3-(2-methyl-1,3-dioxolan-2-yl)propanoate.
Chemical Property Profile of Ethyl 2-methyl-1,3-dioxolane-2-propionate
Property Insights of Ethyl 2-methyl-1,3-dioxolane-2-propionate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-methyl-1,3-dioxolane-2-propionate. With a topological polar surface area (TPSA) of 44.8 Ų, Ethyl 2-methyl-1,3-dioxolane-2-propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-methyl-1,3-dioxolane-2-propionate 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 Ethyl 2-methyl-1,3-dioxolane-2-propionate?
The CAS number of Ethyl 2-methyl-1,3-dioxolane-2-propionate is 941-43-5.
What is the molecular formula of Ethyl 2-methyl-1,3-dioxolane-2-propionate?
The molecular formula of Ethyl 2-methyl-1,3-dioxolane-2-propionate is C9H16O4.
What is the molecular weight of Ethyl 2-methyl-1,3-dioxolane-2-propionate?
The molecular weight of Ethyl 2-methyl-1,3-dioxolane-2-propionate is 188.10 g/mol.
Where can I buy Ethyl 2-methyl-1,3-dioxolane-2-propionate?
You can request a quote for Ethyl 2-methyl-1,3-dioxolane-2-propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-1,3-dioxolane-2-propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-1,3-dioxolane-2-propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.