3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid
TL;DR: 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid (CAS 2163-51-1) is a chemical compound with molecular formula C10H18O3 and molecular weight 186.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-2-methylpropyl)-2,2-dimethylcyclopropane-1-carboxylic acid
Also Known As: 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid, 3-(2-hydroxy-2-methylpropyl)-2,2-dimethylcyclopropane-1-carboxylic acid, RefChem:273703
| Molecular Formula | C10H18O3 |
|---|---|
| Molecular Weight | 186.13 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.1256 |
| Heavy Atoms | 13 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 2163-51-1 |
|---|---|
| SMILES | CC1(C(C1C(=O)O)CC(C)(C)O)C |
| InChIKey | YFMRCDOGWGYUGF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid (CAS 2163-51-1), with molecular formula C10H18O3 and molecular weight 186.13 g/mol. IUPAC: 3-(2-hydroxy-2-methylpropyl)-2,2-dimethylcyclopropane-1-carboxylic acid.
Chemical Property Profile of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid
Property Insights of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid has 2 hydrogen bond donor(s) and 3 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 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid?
The CAS number of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid is 2163-51-1.
What is the molecular formula of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid?
The molecular formula of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid is C10H18O3.
What is the molecular weight of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid?
The molecular weight of 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid is 186.13 g/mol.
Where can I buy 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid?
You can request a quote for 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Hydroxy-2-methylpropyl)-2,2-dimethylcyclopropanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.