3,5-Ditert-butylcyclohexanecarboxylic acid
TL;DR: 3,5-Ditert-butylcyclohexanecarboxylic acid (CAS 101083-13-0) is a chemical compound with molecular formula C15H28O2 and molecular weight 240.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-ditert-butylcyclohexane-1-carboxylic acid
Also Known As: 3-Dodecyl-imidazolidin-2,4-dion, BAS 00119575, 3,5-ditert-butylcyclohexanecarboxylic acid, 3,5-Di-tert-butyl-cyclohexanecarboxylic acid, 3,5-ditert-butylcyclohexane-1-carboxylic acid
| Molecular Formula | C15H28O2 |
|---|---|
| Molecular Weight | 240.21 g/mol |
| LogP | 4.1957 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 240.20892 |
| Heavy Atoms | 17 |
| Complexity | 258.2774 |
Chemical Identifiers
| CAS Number | 101083-13-0 |
|---|---|
| SMILES | CC(C)(C)C1CC(CC(C1)C(C)(C)C)C(=O)O |
Product Overview
3,5-Ditert-butylcyclohexanecarboxylic acid (CAS 101083-13-0), with molecular formula C15H28O2 and molecular weight 240.21 g/mol. IUPAC: 3,5-ditert-butylcyclohexane-1-carboxylic acid.
Chemical Property Profile of 3,5-Ditert-butylcyclohexanecarboxylic acid
Property Insights of 3,5-Ditert-butylcyclohexanecarboxylic acid
The XLogP value of 4.1957 indicates that 3,5-Ditert-butylcyclohexanecarboxylic 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, 3,5-Ditert-butylcyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Ditert-butylcyclohexanecarboxylic 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 3,5-Ditert-butylcyclohexanecarboxylic acid?
The CAS number of 3,5-Ditert-butylcyclohexanecarboxylic acid is 101083-13-0.
What is the molecular formula of 3,5-Ditert-butylcyclohexanecarboxylic acid?
The molecular formula of 3,5-Ditert-butylcyclohexanecarboxylic acid is C15H28O2.
What is the molecular weight of 3,5-Ditert-butylcyclohexanecarboxylic acid?
The molecular weight of 3,5-Ditert-butylcyclohexanecarboxylic acid is 240.21 g/mol.
Where can I buy 3,5-Ditert-butylcyclohexanecarboxylic acid?
You can request a quote for 3,5-Ditert-butylcyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Ditert-butylcyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Ditert-butylcyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.