![Hexanoic acid, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]- structure](/static/products/7207/72076-45-0.webp)
Hexanoic acid, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-
2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoic acid
Also Known As: 2-(2,4-Di-tert-pentylphenoxy)hexanoic acid|2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoic acid|2-(2,4-Bis(tert-pentylphenoxy))hexanoic acid|2-[2,4-bis(tert-pentylphenoxy)]hexanoic acid|Hexanoic acid, 2-(2,4-bis(1,1-dimethylpropyl)phenoxy)-|Hexanoic acid, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-|2-[2,4-bis-(tert-Pentylphenoxy)]hexanoic acid
CAS: 72076-45-0
| Molecular Formula | C22H36O3 |
|---|---|
| Molecular Weight | 348.26645 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 348.26645 |
| Monoisotopic Mass | 348.26645 |
| Heavy Atoms | 25 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 72076-45-0 |
|---|---|
| SMILES | CCCCC(C(=O)O)OC1=C(C=C(C=C1)C(C)(C)CC)C(C)(C)CC |
| InChIKey | YZYMIFDQSDOKLE-UHFFFAOYSA-N |
Product Overview
Hexanoic acid, 2-[2,4-bis(1,1-dimethylpropyl)phenoxy]- (CAS 72076-45-0), with molecular formula C22H36O3 and molecular weight 348.26645 g/mol. IUPAC: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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