tert-butyl (3S)-3-amino-5-methylhexanoate
TL;DR: tert-butyl (3S)-3-amino-5-methylhexanoate (CAS 166023-30-9) is a chemical compound with molecular formula C11H23NO2 and molecular weight 201.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl (3S)-3-amino-5-methylhexanoate
Also Known As: tert-butyl (3S)-3-amino-5-methylhexanoate, (S)-tert-Butyl 3-amino-5-methylhexanoate, tert-Butyl (3S)-3-amino-5-methyl-hexanoate, (S)-tert-Butyl3-amino-5-methylhexanoate, TERT-BUTYL (3S)-3-AMINO-5-METHYLHEXANOATE, 97
Technical Specifications
| Molecular Formula | C11H23NO2 |
| Molecular Weight | 201.17288 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 201.17288 Da |
| Heavy Atoms | 14 |
| Complexity | 182.0 |
| SMILES | CC(C)C[C@@H](CC(=O)OC(C)(C)C)N |
| InChIKey | WBOPVTYXLFEVGP-VIFPVBQESA-N |
Chemical Property Profile of tert-butyl (3S)-3-amino-5-methylhexanoate
Property Insights of tert-butyl (3S)-3-amino-5-methylhexanoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-butyl (3S)-3-amino-5-methylhexanoate. With a topological polar surface area (TPSA) of 52.3 Ų, tert-butyl (3S)-3-amino-5-methylhexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl (3S)-3-amino-5-methylhexanoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of tert-butyl (3S)-3-amino-5-methylhexanoate?
The CAS number of tert-butyl (3S)-3-amino-5-methylhexanoate is 166023-30-9.
What is the molecular formula of tert-butyl (3S)-3-amino-5-methylhexanoate?
The molecular formula of tert-butyl (3S)-3-amino-5-methylhexanoate is C11H23NO2.
What is the molecular weight of tert-butyl (3S)-3-amino-5-methylhexanoate?
The molecular weight of tert-butyl (3S)-3-amino-5-methylhexanoate is 201.17288 g/mol.
Where can I buy tert-butyl (3S)-3-amino-5-methylhexanoate?
You can request a quote for tert-butyl (3S)-3-amino-5-methylhexanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tert-butyl (3S)-3-amino-5-methylhexanoate?
Yes, CoreyChem provides custom synthesis services for tert-butyl (3S)-3-amino-5-methylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.