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The Cyclopropyl-(3-nitrophenyl)methanone, also known as NSC168880, is an organic compound with the formula C10H9NO3. With the CAS registry number 5680-51-3, its IUPAC name is cyclopropyl-(3-nitrophenyl)methanone.
Physical properties of Cyclopropyl-(3-nitrophenyl)methanone: (1)ACD/LogP: 1.86; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 1.621; (5)Molar Refractivity: 50.02 cm3; (6)Molar Volume: 142 cm3; (7)Surface Tension: 59.8 dyne/cm; (8)Density: 1.345 g/cm3; (9)Flash Point: 128.7 °C; (10)Enthalpy of Vaporization: 52.5 kJ/mol; (11)Boiling Point: 285.9 °C at 760 mmHg; (12)Vapour Pressure: 0.00273 mmHg at 25°C.
Preparation: this chemical can be prepared by cyclopropyl-phenyl-methanone. This reaction will need reagent nitric acid.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC1C(=O)C2=CC(=CC=C2)[N+](=O)[O-]
(2)InChI: InChI=1S/C10H9NO3/c12-10(7-4-5-7)8-2-1-3-9(6-8)11(13)14/h1-3,6-7H,4-5H2
(3)InChIKey: SPBSPZKRZGRRSE-UHFFFAOYSA-N