2-(4-Bromophenyl)-2-oxoethyl 4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoate
[2-(4-bromophenyl)-2-oxoethyl] 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
Also Known As: Oprea1_760605|2-(4-bromophenyl)-2-oxoethyl 4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoate|[2-(4-bromophenyl)-2-oxoethyl] 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate
CAS: 438477-95-3
| Molecular Formula | C20H17BrO4 |
|---|---|
| Molecular Weight | 400.031 g/mol |
| LogP | 3.6112 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.031 |
| Monoisotopic Mass | 400.031 |
| Heavy Atoms | 25 |
| Complexity | 819.23035 |
Chemical Identifiers
| CAS Number | 438477-95-3 |
|---|---|
| SMILES | CC(C)(C#CC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br)O |
Product Overview
2-(4-Bromophenyl)-2-oxoethyl 4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoate (CAS 438477-95-3), with molecular formula C20H17BrO4 and molecular weight 400.031 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 4-(3-hydroxy-3-methylbut-1-ynyl)benzoate.
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 →
2-(4-Bromophenyl)-2-oxoethyl 4-(3-hydroxy-3-methylbut-1-yn-1-yl)benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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