Amyl Salicylate
TL;DR: Amyl Salicylate (CAS 2050-08-0) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pentyl 2-hydroxybenzoate
Also Known As: Amyl salicylate, Pentyl salicylate, Pentyl 2-hydroxybenzoate, amylsalicylat, Amylenol
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
| Boiling Point | 268.00 °C. @ 760.00 mm Hg |
| Solubility | 5 mg/L @ 20 °C (exp) |
Chemical Identifiers
| CAS Number | 2050-08-0 |
|---|---|
| SMILES | CCCCCOC(=O)C1=CC=CC=C1O |
| InChIKey | RANVDUNFZBMTBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Amyl Salicylate (CAS 2050-08-0), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: pentyl 2-hydroxybenzoate.
Chemical Property Profile of Amyl Salicylate
Property Insights of Amyl Salicylate
The XLogP value of 5.2 indicates that Amyl 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, Amyl Salicylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Amyl Salicylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amyl Salicylate?
The CAS number of Amyl Salicylate is 2050-08-0.
What is the molecular formula of Amyl Salicylate?
The molecular formula of Amyl Salicylate is C12H16O3.
What is the molecular weight of Amyl Salicylate?
The molecular weight of Amyl Salicylate is 208.11 g/mol.
Where can I buy Amyl Salicylate?
You can request a quote for Amyl Salicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amyl Salicylate?
Yes, KEHONG BIO provides custom synthesis services for Amyl Salicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.