CAS 1134-87-8
:3-benzylpentane-2,4-dione
Description:
3-Benzylpentane-2,4-dione, with the CAS number 1134-87-8, is an organic compound characterized by its diketone structure, featuring two carbonyl (C=O) groups located at the 2 and 4 positions of a pentane chain. The presence of a benzyl group at the 3-position contributes to its aromatic characteristics and influences its reactivity and solubility. This compound typically appears as a colorless to pale yellow liquid and is known for its distinct sweet, caramel-like odor. It is soluble in organic solvents such as ethanol and ether but has limited solubility in water due to its hydrophobic hydrocarbon chain. 3-Benzylpentane-2,4-dione can participate in various chemical reactions, including condensation and oxidation, making it useful in organic synthesis and as an intermediate in the production of pharmaceuticals and fine chemicals. Its diketone functionality also allows for potential applications in coordination chemistry, where it can form complexes with metal ions. Safety data should be consulted for handling, as diketones can pose health risks if inhaled or ingested.
Formula:C12H14O2
InChI:InChI=1/C12H14O2/c1-9(13)12(10(2)14)8-11-6-4-3-5-7-11/h3-7,12H,8H2,1-2H3
SMILES:CC(=O)C(Cc1ccccc1)C(=O)C
Synonyms:- 2,4-Pentanedione, 3-benzyl- (8CI)
- 3-Benzyl-2,4-pentanedione
- Ai3-18949
- Nsc 35139
- 2,4-Pentanedione, 3-(phenylmethyl)-
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