Benzeneacetic acid, I+/--methyl-4-(2-methylpropyl)-, calcium salt (2:1)
calcium bis(2-[4-(2-methylpropyl)phenyl]propanoate)
Also Known As: Ibuprofen Calcium Salt|Calcium 2-[4-(2-methylpropyl)phenyl]propanoate|Benzeneacetic acid, I+/--methyl-4-(2-methylpropyl)-, calcium salt (2:1)
CAS: 63649-75-2
| Molecular Formula | C26H34CaO4 |
|---|---|
| Molecular Weight | 450.2083 g/mol |
| LogP | 3.0962 |
| Topological Polar Surface Area | 80.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 450.2083 |
| Monoisotopic Mass | 450.2083 |
| Heavy Atoms | 31 |
| Complexity | 725.6616 |
Chemical Identifiers
| CAS Number | 63649-75-2 |
|---|---|
| SMILES | CC(C)CC1=CC=C(C=C1)C(C)C(=O)[O-].CC(C)CC1=CC=C(C=C1)C(C)C(=O)[O-].[Ca+2] |
Product Overview
Benzeneacetic acid, I+/--methyl-4-(2-methylpropyl)-, calcium salt (2:1) (CAS 63649-75-2), with molecular formula C26H34CaO4 and molecular weight 450.2083 g/mol. IUPAC: calcium bis(2-[4-(2-methylpropyl)phenyl]propanoate).
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.
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Benzeneacetic acid, I+/--methyl-4-(2-methylpropyl)-, calcium salt (2:1) is a custom synthesis product. We offer services from milligram to kilogram scale.
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