2-Chloro-3,3-dimethylbutanoic acid
TL;DR: 2-Chloro-3,3-dimethylbutanoic acid (CAS 29671-33-8) is a chemical compound with molecular formula C6H11ClO2 and molecular weight 150.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3,3-dimethylbutanoic acid
Also Known As: 2-chloro-3,3-dimethylbutanoic acid, Butanoic acid, 2-chloro-3,3-dimethyl-, 2-chloro-3,3-dimethyl-butanoic Acid
| Molecular Formula | C6H11ClO2 |
|---|---|
| Molecular Weight | 150.04 g/mol |
| LogP | 1.7245 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 150.04475 |
| Heavy Atoms | 9 |
| Complexity | 114.71649 |
Chemical Identifiers
| CAS Number | 29671-33-8 |
|---|---|
| SMILES | CC(C)(C)C(C(=O)O)Cl |
Product Overview
2-Chloro-3,3-dimethylbutanoic acid (CAS 29671-33-8), with molecular formula C6H11ClO2 and molecular weight 150.04 g/mol. IUPAC: 2-chloro-3,3-dimethylbutanoic acid.
Chemical Property Profile of 2-Chloro-3,3-dimethylbutanoic acid
Property Insights of 2-Chloro-3,3-dimethylbutanoic acid
The XLogP value of 1.7245 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-3,3-dimethylbutanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Chloro-3,3-dimethylbutanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-3,3-dimethylbutanoic acid has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Chloro-3,3-dimethylbutanoic acid?
The CAS number of 2-Chloro-3,3-dimethylbutanoic acid is 29671-33-8.
What is the molecular formula of 2-Chloro-3,3-dimethylbutanoic acid?
The molecular formula of 2-Chloro-3,3-dimethylbutanoic acid is C6H11ClO2.
What is the molecular weight of 2-Chloro-3,3-dimethylbutanoic acid?
The molecular weight of 2-Chloro-3,3-dimethylbutanoic acid is 150.04 g/mol.
Where can I buy 2-Chloro-3,3-dimethylbutanoic acid?
You can request a quote for 2-Chloro-3,3-dimethylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-3,3-dimethylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-3,3-dimethylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.