1-Benzoylacetone, 98%, Thermo Scientific Chemicals

Product Code	Brand	Quantity	Packaging
10427670	Thermo Scientific Acros 105690500	50 g	Glass bottle
10569620	Thermo Scientific Acros 105692500	250 g	Glass bottle
11984841	Thermo Scientific Acros 105690010	1 kg	Glass bottle

Description

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Chemical Identifiers

• CAS: 93-91-4
• Molecular Weight (g/mol): 162.19
• InChI Key: CVBUKMMMRLOKQR-UHFFFAOYSA-N
• PubChem CID: 7166
• SMILES: CC(=O)CC(=O)C1=CC=CC=C1

• Molecular Formula: C₁₀H₁₀O₂
• MDL Number: MFCD00008786
• Synonym: benzoylacetone, 1-phenyl-1,3-butanedione, 1-benzoylacetone, 1,3-butanedione, 1-phenyl, 1-benzoyl-2-propanone, acetoacetophenone, 2-propanone, benzoyl, acetylbenzoylmethane, 2-acetylacetophenone, benzoyl-aceton
• IUPAC Name: 1-phenylbutane-1,3-dione

Specifications

• CAS: 93-91-4
• CAS Max %: 100.0
• Color: Yellow
• Infrared Spectrum: Authentic
• Molecular Formula: C₁₀H₁₀O₂
• MDL Number: MFCD00008786
• Specific Gravity: 1.09
• Solubility Information: Solubility in water: insoluble
• SMILES: CC(=O)CC(=O)C1=CC=CC=C1
• Molecular Weight (g/mol): 162.19
• Formula Weight: 162.19
• Physical Form: Crystalline Flakes or Crystalline Powder

• CAS Min %: 97.5
• Melting Point: 54°C to 58°C
• Density: 1.0900g/mL
• Assay Percent Range: 98%
• Linear Formula: C₆H₅COCH₂COCH₃
• Beilstein: 07,68
• Synonym: benzoylacetone, 1-phenyl-1,3-butanedione, 1-benzoylacetone, 1,3-butanedione, 1-phenyl, 1-benzoyl-2-propanone, acetoacetophenone, 2-propanone, benzoyl, acetylbenzoylmethane, 2-acetylacetophenone, benzoyl-aceton
• InChI Key: CVBUKMMMRLOKQR-UHFFFAOYSA-N
• IUPAC Name: 1-phenylbutane-1,3-dione
• PubChem CID: 7166
• Percent Purity: 98%
• Chemical Name or Material: 1-Benzoylacetone, 98%

Safety and Handling

missing translation for 'einecsNumber' : 202-286-4

missing translation for 'rtecsNumber' : EK3540200

missing translation for 'tsca' : TSCA

RUO – Research Use Only