Tricyclohexyl citrate
TL;DR: Tricyclohexyl citrate (CAS 4132-10-9) is a chemical compound with molecular formula C24H38O7 and molecular weight 438.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tricyclohexyl 2-hydroxypropane-1,2,3-tricarboxylate
Also Known As: tricyclohexyl citrate, Tri(cyclohexyl) citrate, Citric acid, tricyclohexyl ester, tricyclohexyl 2-hydroxypropane-1,2,3-tricarboxylate, Benzene, 1-(2,2-dichlorocyclopropyl)-4-fluoro-
| Molecular Formula | C24H38O7 |
|---|---|
| Molecular Weight | 438.26 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 438.26175 |
| Heavy Atoms | 31 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 4132-10-9 |
|---|---|
| SMILES | C1CCC(CC1)OC(=O)CC(CC(=O)OC2CCCCC2)(C(=O)OC3CCCCC3)O |
| InChIKey | CBKMOPGKNJBDFA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tricyclohexyl citrate (CAS 4132-10-9), with molecular formula C24H38O7 and molecular weight 438.26 g/mol. IUPAC: tricyclohexyl 2-hydroxypropane-1,2,3-tricarboxylate.
Chemical Property Profile of Tricyclohexyl citrate
Property Insights of Tricyclohexyl citrate
The XLogP value of 4.4 indicates that Tricyclohexyl citrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Tricyclohexyl citrate. Following Lipinski's Rule of Five, Tricyclohexyl citrate has 1 hydrogen bond donor(s) and 7 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 Tricyclohexyl citrate?
The CAS number of Tricyclohexyl citrate is 4132-10-9.
What is the molecular formula of Tricyclohexyl citrate?
The molecular formula of Tricyclohexyl citrate is C24H38O7.
What is the molecular weight of Tricyclohexyl citrate?
The molecular weight of Tricyclohexyl citrate is 438.26 g/mol.
Where can I buy Tricyclohexyl citrate?
You can request a quote for Tricyclohexyl citrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricyclohexyl citrate?
Yes, KEHONG BIO provides custom synthesis services for Tricyclohexyl citrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.