(2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate
TL;DR: (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate (CAS 76299-61-1) is a chemical compound with molecular formula C9H12O4 and molecular weight 184.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-ethyl-4-methylidene-5-oxooxolan-3-yl) acetate
Also Known As: (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate, (2-ethyl-4-methylidene-5-oxooxolan-3-yl) acetate, 2-ethyl-4-methylidene-5-oxotetrahydrofuran-3-yl acetate, 2-ETHYL-4-METHYLIDENE-5-OXOOXOLAN-3-YL ACETATE, Acetic acid, (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) ester
| Molecular Formula | C9H12O4 |
|---|---|
| Molecular Weight | 184.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.07356 |
| Heavy Atoms | 13 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 76299-61-1 |
|---|---|
| SMILES | CCC1C(C(=C)C(=O)O1)OC(=O)C |
| InChIKey | LRBRZYUYOWTBLH-UHFFFAOYSA-N |
Product Overview
(2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate (CAS 76299-61-1), with molecular formula C9H12O4 and molecular weight 184.07 g/mol. IUPAC: (2-ethyl-4-methylidene-5-oxooxolan-3-yl) acetate.
Chemical Property Profile of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate
Property Insights of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate. With a topological polar surface area (TPSA) of 52.6 Ų, (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate 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 (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate?
The CAS number of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate is 76299-61-1.
What is the molecular formula of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate?
The molecular formula of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate is C9H12O4.
What is the molecular weight of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate?
The molecular weight of (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate is 184.07 g/mol.
Where can I buy (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate?
You can request a quote for (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate?
Yes, KEHONG BIO provides custom synthesis services for (2-ethyl-4-methylidene-5-oxo-oxolan-3-yl) Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.