4-tert-Butylcyclohexane-1-carboxylic acid
TL;DR: 4-tert-Butylcyclohexane-1-carboxylic acid (CAS 943-29-3) is a chemical compound with molecular formula C22H40O4 and molecular weight 368.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butylcyclohexane-1-carboxylic acid
Also Known As: 4-tert-Butylcyclohexane-1-carboxylic acid, trans-4-(tert-Butyl)cyclohexanecarboxylic acid
| Molecular Formula | C22H40O4 |
|---|---|
| Molecular Weight | 368.29 g/mol |
| LogP | 5.847 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 368.29266 |
| Heavy Atoms | 26 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 943-29-3 |
|---|---|
| SMILES | CC(C)(C)C1CCC(CC1)C(=O)O.CC(C)(C)C1CCC(CC1)C(=O)O |
| InChIKey | DWFIANKMRQHTTC-UHFFFAOYSA-N |
Product Overview
4-tert-Butylcyclohexane-1-carboxylic acid (CAS 943-29-3), with molecular formula C22H40O4 and molecular weight 368.29 g/mol. IUPAC: 4-tert-butylcyclohexane-1-carboxylic acid.
Chemical Property Profile of 4-tert-Butylcyclohexane-1-carboxylic acid
Property Insights of 4-tert-Butylcyclohexane-1-carboxylic acid
The XLogP value of 5.847 indicates that 4-tert-Butylcyclohexane-1-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-Butylcyclohexane-1-carboxylic acid. Following Lipinski's Rule of Five, 4-tert-Butylcyclohexane-1-carboxylic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-tert-Butylcyclohexane-1-carboxylic acid?
The CAS number of 4-tert-Butylcyclohexane-1-carboxylic acid is 943-29-3.
What is the molecular formula of 4-tert-Butylcyclohexane-1-carboxylic acid?
The molecular formula of 4-tert-Butylcyclohexane-1-carboxylic acid is C22H40O4.
What is the molecular weight of 4-tert-Butylcyclohexane-1-carboxylic acid?
The molecular weight of 4-tert-Butylcyclohexane-1-carboxylic acid is 368.29 g/mol.
Where can I buy 4-tert-Butylcyclohexane-1-carboxylic acid?
You can request a quote for 4-tert-Butylcyclohexane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-Butylcyclohexane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-Butylcyclohexane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.