Cyclohexyl cyclohexanecarboxylate
TL;DR: Cyclohexyl cyclohexanecarboxylate (CAS 15840-96-7) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl cyclohexanecarboxylate
Also Known As: Cyclohexyl cyclohexanecarboxylate, Cyclohexanecarboxylic acid, cyclohexyl ester, PHENYL BENZOATE, cyclohexyl cyclohexanoate, Benzoic acid phenyl ester
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 15840-96-7 |
|---|---|
| SMILES | C1CCC(CC1)C(=O)OC2CCCCC2 |
| InChIKey | VJCWGXGMXAVKJU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexyl cyclohexanecarboxylate (CAS 15840-96-7), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: cyclohexyl cyclohexanecarboxylate.
Chemical Property Profile of Cyclohexyl cyclohexanecarboxylate
Property Insights of Cyclohexyl cyclohexanecarboxylate
The XLogP value of 4.0 indicates that Cyclohexyl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclohexyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexyl cyclohexanecarboxylate has 0 hydrogen bond donor(s) and 2 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 Cyclohexyl cyclohexanecarboxylate?
The CAS number of Cyclohexyl cyclohexanecarboxylate is 15840-96-7.
What is the molecular formula of Cyclohexyl cyclohexanecarboxylate?
The molecular formula of Cyclohexyl cyclohexanecarboxylate is C13H22O2.
What is the molecular weight of Cyclohexyl cyclohexanecarboxylate?
The molecular weight of Cyclohexyl cyclohexanecarboxylate is 210.16 g/mol.
Where can I buy Cyclohexyl cyclohexanecarboxylate?
You can request a quote for Cyclohexyl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexyl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.