2-Tert-butyl-2,3,3-trimethylbutanoic acid
TL;DR: 2-Tert-butyl-2,3,3-trimethylbutanoic acid (CAS 16021-12-8) is a chemical compound with molecular formula C11H22O2 and molecular weight 186.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-tert-butyl-2,3,3-trimethylbutanoic acid
Also Known As: 2-tert-butyl-2,3,3-trimethylbutanoic acid, 2-tert-butyl-2,3,3-trimethyl-butyric acid, BUTANOIC ACID,2-(1,1-DIMETHYLETHYL)-2,3,3-TRIMETHYL-
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H22O2 |
| Molecular Weight | 186.16199 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.16199 Da |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
| SMILES | CC(C)(C)C(C)(C(=O)O)C(C)(C)C |
| InChIKey | LVAGKFXWQHOSOQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Tert-butyl-2,3,3-trimethylbutanoic acid
Property Insights of 2-Tert-butyl-2,3,3-trimethylbutanoic acid
The XLogP value of 3.6 indicates that 2-Tert-butyl-2,3,3-trimethylbutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Tert-butyl-2,3,3-trimethylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-2,3,3-trimethylbutanoic acid 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 2-Tert-butyl-2,3,3-trimethylbutanoic acid?
The CAS number of 2-Tert-butyl-2,3,3-trimethylbutanoic acid is 16021-12-8.
What is the molecular formula of 2-Tert-butyl-2,3,3-trimethylbutanoic acid?
The molecular formula of 2-Tert-butyl-2,3,3-trimethylbutanoic acid is C11H22O2.
What is the molecular weight of 2-Tert-butyl-2,3,3-trimethylbutanoic acid?
The molecular weight of 2-Tert-butyl-2,3,3-trimethylbutanoic acid is 186.16199 g/mol.
Where can I buy 2-Tert-butyl-2,3,3-trimethylbutanoic acid?
You can request a quote for 2-Tert-butyl-2,3,3-trimethylbutanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Tert-butyl-2,3,3-trimethylbutanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Tert-butyl-2,3,3-trimethylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.