4-tert-Butoxy-4-oxobutan-2-aminium
TL;DR: 4-tert-Butoxy-4-oxobutan-2-aminium (CAS 158849-23-1) is a chemical compound with molecular formula C8H18NO2+ and molecular weight 160.13376 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]azanium
Also Known As: 4-tert-Butoxy-4-oxobutan-2-aminium, (2R)-4-tert-Butoxy-4-oxobutan-2-aminium, [(2R)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutan-2-yl]azanium
Technical Specifications
| Molecular Formula | C8H18NO2+ |
| Molecular Weight | 160.13376 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 53.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 160.13376 Da |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
| SMILES | C[C@H](CC(=O)OC(C)(C)C)[NH3+] |
| InChIKey | BFFNZGWJTHWUMY-ZCFIWIBFSA-O |
Chemical Property Profile of 4-tert-Butoxy-4-oxobutan-2-aminium
Property Insights of 4-tert-Butoxy-4-oxobutan-2-aminium
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-tert-Butoxy-4-oxobutan-2-aminium. With a topological polar surface area (TPSA) of 53.9 Ų, 4-tert-Butoxy-4-oxobutan-2-aminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-Butoxy-4-oxobutan-2-aminium has 1 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 4-tert-Butoxy-4-oxobutan-2-aminium?
The CAS number of 4-tert-Butoxy-4-oxobutan-2-aminium is 158849-23-1.
What is the molecular formula of 4-tert-Butoxy-4-oxobutan-2-aminium?
The molecular formula of 4-tert-Butoxy-4-oxobutan-2-aminium is C8H18NO2+.
What is the molecular weight of 4-tert-Butoxy-4-oxobutan-2-aminium?
The molecular weight of 4-tert-Butoxy-4-oxobutan-2-aminium is 160.13376 g/mol.
Where can I buy 4-tert-Butoxy-4-oxobutan-2-aminium?
You can request a quote for 4-tert-Butoxy-4-oxobutan-2-aminium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-tert-Butoxy-4-oxobutan-2-aminium?
Yes, CoreyChem provides custom synthesis services for 4-tert-Butoxy-4-oxobutan-2-aminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.