1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-
TL;DR: 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- (CAS 87944-76-1) is a chemical compound with molecular formula C22H38O3 and molecular weight 350.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexadecanoylcyclohexane-1,3-dione
Also Known As: 2-hexadecanoylcyclohexane-1,3-dione, 2-palmitoyl-1,3-cyclohexanedione, 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-
| Molecular Formula | C22H38O3 |
|---|---|
| Molecular Weight | 350.28 g/mol |
| LogP | 5.9751 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 350.2821 |
| Heavy Atoms | 25 |
| Complexity | 384.0765 |
Chemical Identifiers
| CAS Number | 87944-76-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)C1C(=O)CCCC1=O |
Product Overview
1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- (CAS 87944-76-1), with molecular formula C22H38O3 and molecular weight 350.28 g/mol. IUPAC: 2-hexadecanoylcyclohexane-1,3-dione.
Chemical Property Profile of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-
Property Insights of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-
The XLogP value of 5.9751 indicates that 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.21 Ų, 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- has 0 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 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-?
The CAS number of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- is 87944-76-1.
What is the molecular formula of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-?
The molecular formula of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- is C22H38O3.
What is the molecular weight of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-?
The molecular weight of 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- is 350.28 g/mol.
Where can I buy 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-?
You can request a quote for 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Cyclohexanedione, 2-(1-oxohexadecyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.