N-Isopropylphthalimide

The IUPAC name of N-Isopropylphthalimide is 2-propan-2-ylisoindole-1,3-dione. With the CAS registry number 304-17-6, it is also named as Isopropyl phthalimide. The product's category is Derivatives of Phthalimide. Besides, it is slight yellow liquid. In addition, its molecular formula is C₁₁H₁₁NO₂ and molecular weight is 189.22.

The other characteristics of N-Isopropylphthalimide can be summarized as: (1)EINECS: 206-150-5; (2)ACD/LogP: 2.44; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 2.43; (5)ACD/LogD (pH 7.4): 2.43; (6)ACD/BCF (pH 5.5): 41.72; (7)ACD/BCF (pH 7.4): 41.72; (8)ACD/KOC (pH 5.5): 502.84; (9)ACD/KOC (pH 7.4): 502.84; (10)#H bond acceptors: 3; (11)#H bond donors: 0; (12)#Freely Rotating Bonds: 1; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 51.5 cm³; (15)Molar Volume: 154.6 cm³; (16)Surface Tension: 48 dyne/cm; (17)Density: 1.223 g/cm³; (18)Flash Point: 121.1 °C; (19)Melting Point: 82-84 °C; (20)Enthalpy of Vaporization: 52.63 kJ/mol; (21)Boiling Point: 287.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00253 mmHg at 25 °C.

Preparation of this chemical: this chemical can be prepared by the reaction of N-Hydroxy-phthalimide with Isopropylamine.



This reaction needs Ethanol for 4 hours. The yield is 79 %.

Uses of this chemical: it can react with Prop-2-ynyl-magnesium bromide to get 3-Hydroxy-2-isopropyl-3-prop-2-ynyl-2,3-dihydro-isoindol-1-one.



This reaction needs Tetrahydrofuran and Diethyl ether at temperature of 0 °C for 5 min. The yield is 94 %.

People can use the following data to convert to the molecule structure.
(1)Canonical SMILES: CC(C)N1C(=O)C2=CC=CC=C2C1=O
(2)InChI: InChI=1S/C11H11NO2/c1-7(2)12-10(13)8-5-3-4-6-9(8)11(12)14/h3-7H,1-2H3
(3)InChIKey: VPLDXHDOGVIETL-UHFFFAOYSA-N 

The toxicity data is as follows: