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2H-Indol-2-one,1,3-dihydro-7-(trifluoromethyl)- (56341-40-3)

Identification
Name:2H-Indol-2-one,1,3-dihydro-7-(trifluoromethyl)-
Synonyms:2-Oxo-7-(trifluoromethyl)indoline;7-(Trifluoromethyl)indolin-2-one;7-(Trifluoromethyl)oxindole;
CAS:56341-40-3
Molecular Formula: C9H6F3NO
Molecular Weight: 201.15
InChI: InChI=1/C9H6F3NO/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-3H,4H2,(H,13,14)
Molecular Structure: (C9H6F3NO) 2-Oxo-7-(trifluoromethyl)indoline;7-(Trifluoromethyl)indolin-2-one;7-(Trifluoromethyl)oxindole;
Properties
Density:1.391g/cm3
Refractive index:1.496
Specification:

The 7-Trifluoromethyloxindole with cas registry number of 56341-40-3, belongs to the following product categories: (1)blocks; (2)FluoroCompounds; (3)IndolesOxindoles; (4)Indoline & Oxindole. It has the systematic name of 7-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one.

Physical properties about this chemical are: (1)ACD/LogP: 1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.03; (4)ACD/LogD (pH 7.4): 1.03; (5)ACD/BCF (pH 5.5): 3.58; (6)ACD/BCF (pH 7.4): 3.58; (7)ACD/KOC (pH 5.5): 86.73; (8)ACD/KOC (pH 7.4): 86.73; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31Å2; (13)Index of Refraction: 1.496; (14)Molar Refractivity: 42.27 cm3; (15)Molar Volume: 144.5 cm3; (16)Polarizability: 16.75×10-24cm3; (17)Surface Tension: 33.5 dyne/cm; (18)Enthalpy of Vaporization: 52.29 kJ/mol; (19)Vapour Pressure: 0.00306 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: FC(F)(F)c1cccc2c1NC(=O)C2;
(2)InChI: InChI=1/C9H6F3NO/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-3H,4H2,(H,13,14);
(3)InChIKey: ODADMQRQVQRBAC-UHFFFAOYAZ;
(4)Std. InChI: InChI=1S/C9H6F3NO/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-3H,4H2,(H,13,14);
(5)Std. InChIKey: ODADMQRQVQRBAC-UHFFFAOYSA-N

Safety Data
 

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