Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester
TL;DR: Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester (CAS 73255-65-9) is a chemical compound with molecular formula C21H38O2 and molecular weight 322.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-propylcyclohexyl) 4-pentylcyclohexane-1-carboxylate
Also Known As: 4-Propylcyclohexyl 4-pentylcyclohexanecarboxylate, J2.118.687B, 4-propylcyclohexyl 4-pentylcyclohexane-1-carboxylate, 4-Propylcyclohexyl 4-pentylcyclohexanecarboxylate #, (4-propylcyclohexyl) 4-pentylcyclohexane-1-carboxylate
| Molecular Formula | C21H38O2 |
|---|---|
| Molecular Weight | 322.29 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 322.28717 |
| Heavy Atoms | 23 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 73255-65-9 |
|---|---|
| SMILES | CCCCCC1CCC(CC1)C(=O)OC2CCC(CC2)CCC |
| InChIKey | SQVAZYCIRMBSMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester (CAS 73255-65-9), with molecular formula C21H38O2 and molecular weight 322.29 g/mol. IUPAC: (4-propylcyclohexyl) 4-pentylcyclohexane-1-carboxylate.
Chemical Property Profile of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester
Property Insights of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester
The XLogP value of 7.8 indicates that Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester?
The CAS number of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester is 73255-65-9.
What is the molecular formula of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester?
The molecular formula of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester is C21H38O2.
What is the molecular weight of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester?
The molecular weight of Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester is 322.29 g/mol.
Where can I buy Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester?
You can request a quote for Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanecarboxylic acid, 4-pentyl-, 4-propylcyclohexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.