p-Cresyl salicylate
TL;DR: p-Cresyl salicylate (CAS 607-88-5) is a chemical compound with molecular formula C14H12O3 and molecular weight 228.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylphenyl) 2-hydroxybenzoate
Also Known As: p-Tolyl salicylate, p-tolyl 2-hydroxybenzoate, p-Cresyl salicylate, 4-Methylphenyl salicylate, Salicylic Acid p-Tolyl Ester
| Molecular Formula | C14H12O3 |
|---|---|
| Molecular Weight | 228.08 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.07864 |
| Heavy Atoms | 17 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 607-88-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O |
| InChIKey | AMYKXJAXRJCLCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Cresyl salicylate (CAS 607-88-5), with molecular formula C14H12O3 and molecular weight 228.08 g/mol. IUPAC: (4-methylphenyl) 2-hydroxybenzoate.
Chemical Property Profile of p-Cresyl salicylate
Property Insights of p-Cresyl salicylate
The XLogP value of 4.1 indicates that p-Cresyl salicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, p-Cresyl salicylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Cresyl salicylate has 1 hydrogen bond donor(s) and 3 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 p-Cresyl salicylate?
The CAS number of p-Cresyl salicylate is 607-88-5.
What is the molecular formula of p-Cresyl salicylate?
The molecular formula of p-Cresyl salicylate is C14H12O3.
What is the molecular weight of p-Cresyl salicylate?
The molecular weight of p-Cresyl salicylate is 228.08 g/mol.
Where can I buy p-Cresyl salicylate?
You can request a quote for p-Cresyl salicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Cresyl salicylate?
Yes, KEHONG BIO provides custom synthesis services for p-Cresyl salicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.