4-Tert-butyl-2-(1-phenylethyl)phenyl butanoate
[4-tert-butyl-2-(1-phenylethyl)phenyl] butanoate
Also Known As: [2-4-tert-butyl-phenyl]butanoate|4-tert-butyl-2-(1-phenylethyl)phenyl butanoate|[2- -4-tert-butyl-phenyl]butanoate|[4-tert-butyl-2-(1-phenylethyl)phenyl] butanoate|4-(2-Methyl-2-propanyl)-2-(1-phenylethyl)phenyl butyrate|Butanoic acid,4-(1,1-dimethylethyl)-2-(1-phenylethyl)phenyl ester
CAS: 699-90-1
| Molecular Formula | C22H28O2 |
|---|---|
| Molecular Weight | 324.20892 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 324.20892 |
| Monoisotopic Mass | 324.20892 |
| Heavy Atoms | 24 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 699-90-1 |
|---|---|
| SMILES | CCCC(=O)OC1=C(C=C(C=C1)C(C)(C)C)C(C)C2=CC=CC=C2 |
| InChIKey | XHNMDNGGVMGLOL-UHFFFAOYSA-N |
Product Overview
4-Tert-butyl-2-(1-phenylethyl)phenyl butanoate (CAS 699-90-1), with molecular formula C22H28O2 and molecular weight 324.20892 g/mol. IUPAC: [4-tert-butyl-2-(1-phenylethyl)phenyl] butanoate.
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 →
4-Tert-butyl-2-(1-phenylethyl)phenyl butanoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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