Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester
TL;DR: Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester (CAS 346447-40-3) is a chemical compound with molecular formula C27H42O2 and molecular weight 398.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(4-propylcyclohexyl)phenyl] 4-pentylcyclohexane-1-carboxylate
Also Known As: EINECS 280-292-6, trans-4- phenyltrans-4-pentylcyclohexanecarboxylate, trans-4-(4-Propylcyclohexyl)phenyl trans-4-pentylcyclohexanecarboxylate, [4-(4-propylcyclohexyl)phenyl] 4-pentylcyclohexane-1-carboxylate, Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester
| Molecular Formula | C27H42O2 |
|---|---|
| Molecular Weight | 398.32 g/mol |
| LogP | 8.0526 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.31848 |
| Heavy Atoms | 29 |
| Complexity | 589.46875 |
Chemical Identifiers
| CAS Number | 346447-40-3 |
|---|---|
| SMILES | CCCCCC1CCC(CC1)C(=O)OC2=CC=C(C=C2)C3CCC(CC3)CCC |
Product Overview
Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester (CAS 346447-40-3), with molecular formula C27H42O2 and molecular weight 398.32 g/mol. IUPAC: [4-(4-propylcyclohexyl)phenyl] 4-pentylcyclohexane-1-carboxylate.
Chemical Property Profile of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester
Property Insights of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester
The XLogP value of 8.0526 indicates that Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl 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-(4-propylcyclohexyl)phenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl 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-(4-propylcyclohexyl)phenyl ester?
The CAS number of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester is 346447-40-3.
What is the molecular formula of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester?
The molecular formula of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester is C27H42O2.
What is the molecular weight of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester?
The molecular weight of Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester is 398.32 g/mol.
Where can I buy Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester?
You can request a quote for Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl 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-(4-propylcyclohexyl)phenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanecarboxylic acid, 4-pentyl-, 4-(4-propylcyclohexyl)phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.