![Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester structure](/static/products/567/56712-07-3.png)
Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester
TL;DR: Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester (CAS 56712-07-3) is a chemical compound with molecular formula C37H72O5 and molecular weight 596.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-hexadecanoylperoxy-3-methylbutyl) hexadecanoate
Also Known As: 3-Methyl-3-(palmitoylperoxy)butyl palmitate, Hexadecaneperoxoicacid1,1-dimethyl-3- propylester, 3-Methyl-3-(palmitoylperoxy)butyl palmitate #, (3-hexadecanoylperoxy-3-methylbutyl) hexadecanoate, 3-(hexadecanoylperoxy)-3-methylbutyl hexadecanoate
| Molecular Formula | C37H72O5 |
|---|---|
| Molecular Weight | 596.54 g/mol |
| LogP | 15.7 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 35 |
| Exact Mass | 596.53796 |
| Heavy Atoms | 42 |
| Complexity | 589.0 |
Chemical Identifiers
| CAS Number | 56712-07-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCCC(C)(C)OOC(=O)CCCCCCCCCCCCCCC |
| InChIKey | QGAZLSXCSKPXGN-UHFFFAOYSA-N |
Product Overview
Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester (CAS 56712-07-3), with molecular formula C37H72O5 and molecular weight 596.54 g/mol. IUPAC: (3-hexadecanoylperoxy-3-methylbutyl) hexadecanoate.
Chemical Property Profile of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester
Property Insights of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester
The XLogP value of 15.7 indicates that Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester. Following Lipinski's Rule of Five, Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester?
The CAS number of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester is 56712-07-3.
What is the molecular formula of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester?
The molecular formula of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester is C37H72O5.
What is the molecular weight of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester?
The molecular weight of Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester is 596.54 g/mol.
Where can I buy Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester?
You can request a quote for Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hexadecaneperoxoic acid, 1,1-dimethyl-3-[(1-oxohexadecyl)oxy]propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.