5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid
TL;DR: 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid (CAS 33964-82-8) is a chemical compound with molecular formula C11H20O3 and molecular weight 200.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-2-hydroxycyclohexane-1-carboxylic acid
Also Known As: 5-tert-butyl-2-hydroxycyclohexanecarboxylic acid, 5-tert-butyl-2-hydroxycyclohexane-1-carboxylic acid, 5-tert-butyl-2-hydroxy-1-cyclohexanecarboxylic acid, 5-tert-butyl-2-oxidanyl-cyclohexane-1-carboxylic acid, (1alpha,2beta,5alpha)-5-(1,1-Dimethylethyl)-2-hydroxycyclohexanecarboxylic acid
| Molecular Formula | C11H20O3 |
|---|---|
| Molecular Weight | 200.14 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.14125 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 33964-82-8 |
|---|---|
| SMILES | CC(C)(C)C1CCC(C(C1)C(=O)O)O |
| InChIKey | PYEOMDZPPRSCOZ-UHFFFAOYSA-N |
Product Overview
5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid (CAS 33964-82-8), with molecular formula C11H20O3 and molecular weight 200.14 g/mol. IUPAC: 5-tert-butyl-2-hydroxycyclohexane-1-carboxylic acid.
Chemical Property Profile of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid
Property Insights of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid. With a topological polar surface area (TPSA) of 57.5 Ų, 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Tert-butyl-2-hydroxycyclohexanecarboxylic 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 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid?
The CAS number of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid is 33964-82-8.
What is the molecular formula of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid?
The molecular formula of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid is C11H20O3.
What is the molecular weight of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid?
The molecular weight of 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid is 200.14 g/mol.
Where can I buy 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid?
You can request a quote for 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Tert-butyl-2-hydroxycyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.