Hexadecan-2-yl acetate
TL;DR: Hexadecan-2-yl acetate (CAS 37590-88-8) is a chemical compound with molecular formula C18H36O2 and molecular weight 284.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexadecan-2-yl acetate
Also Known As: hexadecan-2-yl acetate, 2-Hexadecanol acetate, 2-acetoxy hexadecane, 1-Methylpentadecylacetate, 2-Hexadecanol,2-acetate
| Molecular Formula | C18H36O2 |
|---|---|
| Molecular Weight | 284.27 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Exact Mass | 284.27155 |
| Heavy Atoms | 20 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 37590-88-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCC(C)OC(=O)C |
| InChIKey | WOIRJSBJPOCNST-UHFFFAOYSA-N |
Product Overview
Hexadecan-2-yl acetate (CAS 37590-88-8), with molecular formula C18H36O2 and molecular weight 284.27 g/mol. IUPAC: hexadecan-2-yl acetate.
Chemical Property Profile of Hexadecan-2-yl acetate
Property Insights of Hexadecan-2-yl acetate
The XLogP value of 7.8 indicates that Hexadecan-2-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Hexadecan-2-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hexadecan-2-yl acetate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexadecan-2-yl acetate?
The CAS number of Hexadecan-2-yl acetate is 37590-88-8.
What is the molecular formula of Hexadecan-2-yl acetate?
The molecular formula of Hexadecan-2-yl acetate is C18H36O2.
What is the molecular weight of Hexadecan-2-yl acetate?
The molecular weight of Hexadecan-2-yl acetate is 284.27 g/mol.
Where can I buy Hexadecan-2-yl acetate?
You can request a quote for Hexadecan-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecan-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for Hexadecan-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.