Butyl palmitate
TL;DR: Butyl palmitate (CAS 111-06-8) is a chemical compound with molecular formula C20H40O2 and molecular weight 312.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl hexadecanoate
Also Known As: BUTYL PALMITATE, Butyl hexadecanoate, n-Butyl palmitate, Hexadecanoic acid, butyl ester, n-Butyl hexadecanoate
| Molecular Formula | C20H40O2 |
|---|---|
| Molecular Weight | 312.30 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 312.30283 |
| Heavy Atoms | 22 |
| Complexity | 226.0 |
| Vapor Pressure | 0.0000172 [mmHg] |
Chemical Identifiers
| CAS Number | 111-06-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCCC |
| InChIKey | GLYJVQDYLFAUFC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl palmitate (CAS 111-06-8), with molecular formula C20H40O2 and molecular weight 312.30 g/mol. IUPAC: butyl hexadecanoate.
Chemical Property Profile of Butyl palmitate
Property Insights of Butyl palmitate
The XLogP value of 8.7 indicates that Butyl palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl palmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl palmitate 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 Butyl palmitate?
The CAS number of Butyl palmitate is 111-06-8.
What is the molecular formula of Butyl palmitate?
The molecular formula of Butyl palmitate is C20H40O2.
What is the molecular weight of Butyl palmitate?
The molecular weight of Butyl palmitate is 312.30 g/mol.
Where can I buy Butyl palmitate?
You can request a quote for Butyl palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl palmitate?
Yes, KEHONG BIO provides custom synthesis services for Butyl palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.