4-Methylphenyl cyclohexanecarboxylate
TL;DR: 4-Methylphenyl cyclohexanecarboxylate (CAS 14224-22-7) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) cyclohexanecarboxylate
Also Known As: 4-Methylphenyl cyclohexanecarboxylate, (4-methylphenyl) cyclohexanecarboxylate, p-cresyl cyclohexanecarboxylate, 4-methylphenylcyclohexanecarboxylate, Cyclohexanecarboxylic acid, 4-methylphenyl ester
| Molecular Formula | C14H18O2 |
|---|---|
| Molecular Weight | 218.13 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 218.13068 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 14224-22-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC(=O)C2CCCCC2 |
| InChIKey | ROILWCFQYYHWEB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylphenyl cyclohexanecarboxylate (CAS 14224-22-7), with molecular formula C14H18O2 and molecular weight 218.13 g/mol. IUPAC: (4-methylphenyl) cyclohexanecarboxylate.
Chemical Property Profile of 4-Methylphenyl cyclohexanecarboxylate
Property Insights of 4-Methylphenyl cyclohexanecarboxylate
The XLogP value of 4.1 indicates that 4-Methylphenyl 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, 4-Methylphenyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylphenyl 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 4-Methylphenyl cyclohexanecarboxylate?
The CAS number of 4-Methylphenyl cyclohexanecarboxylate is 14224-22-7.
What is the molecular formula of 4-Methylphenyl cyclohexanecarboxylate?
The molecular formula of 4-Methylphenyl cyclohexanecarboxylate is C14H18O2.
What is the molecular weight of 4-Methylphenyl cyclohexanecarboxylate?
The molecular weight of 4-Methylphenyl cyclohexanecarboxylate is 218.13 g/mol.
Where can I buy 4-Methylphenyl cyclohexanecarboxylate?
You can request a quote for 4-Methylphenyl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylphenyl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylphenyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.