Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester
TL;DR: Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester (CAS 59382-51-3) is a chemical compound with molecular formula C16H24O4 and molecular weight 280.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4-trimethylpentan-2-yl 2-phenoxyethaneperoxoate
Also Known As: 1,1,3,3-Tetramethylbutyl phenoxyperoxyacetate, Ethaneperoxoic acid, phenoxy-, 1,1,3,3-tetramethylbutyl ester, 2,4,4-trimethylpentan-2-yl 2-phenoxyethaneperoxoate, 2,4,4-trimethylpentan-2-yl phenoxyethaneperoxoate, Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester
| Molecular Formula | C16H24O4 |
|---|---|
| Molecular Weight | 280.17 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 280.16745 |
| Heavy Atoms | 20 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 59382-51-3 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)OOC(=O)COC1=CC=CC=C1 |
| InChIKey | WQXWDMWCSZQRFW-UHFFFAOYSA-N |
Product Overview
Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester (CAS 59382-51-3), with molecular formula C16H24O4 and molecular weight 280.17 g/mol. IUPAC: 2,4,4-trimethylpentan-2-yl 2-phenoxyethaneperoxoate.
Chemical Property Profile of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester
Property Insights of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester
The XLogP value of 4.6 indicates that Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester?
The CAS number of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester is 59382-51-3.
What is the molecular formula of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester?
The molecular formula of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester is C16H24O4.
What is the molecular weight of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester?
The molecular weight of Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester is 280.17 g/mol.
Where can I buy Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester?
You can request a quote for Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Ethaneperoxoic acid, 2-phenoxy-, 1,1,3,3-tetramethylbutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.