alpha-t-Butyl-gamma-butyrolactone
TL;DR: alpha-t-Butyl-gamma-butyrolactone (CAS 131424-13-0) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-tert-butyloxolan-2-one
Also Known As: 3-tert-butyloxolan-2-one, alpha-t-Butyl-gamma-butyrolactone, 4,5-Dihydro-3-tert-butylfuran-2(3H)-one, 2(3H)-Furanone, 3-(1,1-dimethylethyl)dihydro-
Technical Specifications
| Molecular Formula | C8H14O2 |
| Molecular Weight | 142.09938 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.09938 Da |
| Heavy Atoms | 10 |
| Complexity | 144.0 |
| SMILES | CC(C)(C)C1CCOC1=O |
| InChIKey | TWXRMSXTRBJWBS-UHFFFAOYSA-N |
Chemical Property Profile of alpha-t-Butyl-gamma-butyrolactone
Property Insights of alpha-t-Butyl-gamma-butyrolactone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-t-Butyl-gamma-butyrolactone. With a topological polar surface area (TPSA) of 26.3 Ų, alpha-t-Butyl-gamma-butyrolactone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-t-Butyl-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 alpha-t-Butyl-gamma-butyrolactone?
The CAS number of alpha-t-Butyl-gamma-butyrolactone is 131424-13-0.
What is the molecular formula of alpha-t-Butyl-gamma-butyrolactone?
The molecular formula of alpha-t-Butyl-gamma-butyrolactone is C8H14O2.
What is the molecular weight of alpha-t-Butyl-gamma-butyrolactone?
The molecular weight of alpha-t-Butyl-gamma-butyrolactone is 142.09938 g/mol.
Where can I buy alpha-t-Butyl-gamma-butyrolactone?
You can request a quote for alpha-t-Butyl-gamma-butyrolactone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-t-Butyl-gamma-butyrolactone?
Yes, CoreyChem provides custom synthesis services for alpha-t-Butyl-gamma-butyrolactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.