beta-Ethyl-beta-methyl-gamma-butyrolactone
TL;DR: beta-Ethyl-beta-methyl-gamma-butyrolactone (CAS 50598-34-0) is a chemical compound with molecular formula C7H12O2 and molecular weight 128.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethyl-4-methyloxolan-2-one
Also Known As: beta-EMGBL, 4-ethyl-4-methyloxolan-2-one, Dihydro-4-ethyl-4-methyl-2(3H)-furanone, 2-Ethyl-2-methyl-4-butyrolactone, beta-Ethyl-beta-methyl-gamma-butyrolactone
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H12O2 |
| Molecular Weight | 128.08372 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 128.08372 Da |
| Heavy Atoms | 9 |
| Complexity | 131.0 |
| SMILES | CCC1(CC(=O)OC1)C |
| InChIKey | CHDAMWZEYINXCG-UHFFFAOYSA-N |
Chemical Property Profile of beta-Ethyl-beta-methyl-gamma-butyrolactone
Property Insights of beta-Ethyl-beta-methyl-gamma-butyrolactone
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Ethyl-beta-methyl-gamma-butyrolactone. With a topological polar surface area (TPSA) of 26.3 Ų, beta-Ethyl-beta-methyl-gamma-butyrolactone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Ethyl-beta-methyl-gamma-butyrolactone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of beta-Ethyl-beta-methyl-gamma-butyrolactone?
The CAS number of beta-Ethyl-beta-methyl-gamma-butyrolactone is 50598-34-0.
What is the molecular formula of beta-Ethyl-beta-methyl-gamma-butyrolactone?
The molecular formula of beta-Ethyl-beta-methyl-gamma-butyrolactone is C7H12O2.
What is the molecular weight of beta-Ethyl-beta-methyl-gamma-butyrolactone?
The molecular weight of beta-Ethyl-beta-methyl-gamma-butyrolactone is 128.08372 g/mol.
Where can I buy beta-Ethyl-beta-methyl-gamma-butyrolactone?
You can request a quote for beta-Ethyl-beta-methyl-gamma-butyrolactone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Ethyl-beta-methyl-gamma-butyrolactone?
Yes, CoreyChem provides custom synthesis services for beta-Ethyl-beta-methyl-gamma-butyrolactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.