The 1,3-Diacetylbenzene, with the CAS registry number 6781-42-6, is also known as 1,3-Bis(1-oxoethyl)benzene. It belongs to the product categories of Aromatic Ketones (substituted); C₁₀; Carbonyl Compounds; Ketones. Its EINECS number is 229-842-9. This chemical's molecular formula is C₁₀H₁₀O₂ and formula weight is 162.19. What's more, its IUPAC name is 1-(3-acetylphenyl)ethanone. You should not breathe dust. When using it, you should avoid contacting with skin and eyes.

Physical properties of 1,3-Diacetylbenzene are: (1)ACD/LogP: 1.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.43; (4)ACD/BCF (pH 5.5): 7.19; (5)ACD/KOC (pH 5.5): 142.86; (6)#H bond acceptors: 2; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 34.14 Å²; (10)Index of Refraction: 1.519; (11)Molar Refractivity: 46.3 cm³; (12)Molar Volume: 152.4 cm³; (13)Surface Tension: 37.6 dyne/cm; (14)Density: 1.063 g/cm³; (15)Flash Point: 108.5 °C; (16)Enthalpy of Vaporization: 51.9 kJ/mol; (17)Boiling Point: 280.3 °C at 760 mmHg; (18)Vapour Pressure: 0.00382 mmHg at 25°C.

Preparation: this chemical can be prepared by 1,3-bis(2-methyl-1,3-dithiolan-2-yl)benzene at the temperature of 23 °C. This reaction will need reagent water, N-fluoro-2,4,6-trimethylpyridinium trifluoromethanesulfonate and solvent CH₂Cl₂, tetrahydrofuran. The yield is about 52%.

Uses of 1,3-Diacetylbenzene: it can be used to produce 1-(3-acetyl-phenyl)-2-bromo-ethanone at the ambient temperature. It will need reagent bromine and solvent dioxane, diethyl ether with the reaction time of 0.5 hour. The yield is about 100%.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=CC(=CC=C1)C(=O)C
(2)InChI: InChI=1S/C10H10O2/c1-7(11)9-4-3-5-10(6-9)8(2)12/h3-6H,1-2H3
(3)InChIKey: VCHOFVSNWYPAEF-UHFFFAOYSA-N