2-ISOPROPYLACETANILIDE

The Acetamide,N-[2-(1-methylethyl)phenyl]-, with the CAS registry number 19246-04-9, is also known as 2'-Isopropylacetanilide. This chemical's molecular formula is C₁₁H₁₅NO and molecular weight is 177.24. What's more, its systematic name is N-[2-(1-Methylethyl)phenyl]acetamide. It should be preserved hermetically and put in a dry place; avoid light.

Physical properties about Acetamide,N-[2-(1-methylethyl)phenyl]-: (1)ACD/LogP: 2.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.42; (4)ACD/LogD (pH 7.4): 2.42; (5)ACD/BCF (pH 5.5): 40.75; (6)ACD/BCF (pH 7.4): 40.76; (7)ACD/KOC (pH 5.5): 494.51; (8)ACD/KOC (pH 7.4): 494.53; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.31 Å²; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 54.7 cm³; (15)Molar Volume: 172.5 cm³; (16)Surface Tension: 37.1 dyne/cm; (17)Density: 1.026 g/cm³; (18)Flash Point: 188.2 °C; (19)Enthalpy of Vaporization: 56.08 kJ/mol; (20)Boiling Point: 319.2 °C at 760 mmHg; (21)Vapour Pressure: 0.000344 mmHg at 25 °C; (22)Melting point: 72-74 °C.

When you are dealing with this chemical, you should be very careful. This chemical is inflammation to the skin, eyes and respiratory system or other mucous membranes. If swallowed, it is harmful to health. Therefore, you should wear suitable protective clothing and gloves. And in case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1ccccc1C(C)C)C
(2) InChI: InChI=1/C11H15NO/c1-8(2)10-6-4-5-7-11(10)12-9(3)13/h4-8H,1-3H3,(H,12,13)
(3) InChIKey: PTHQJQDKJOVFRD-UHFFFAOYAL