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1H-Indole,5-fluoro-2,3-dimethyl- (526-47-6)

Identification
Name:1H-Indole,5-fluoro-2,3-dimethyl-
Synonyms:Indole,5-fluoro-2,3-dimethyl- (6CI,7CI,8CI);5-Fluoro-2,3-dimethylindole;
CAS:526-47-6
Molecular Formula: C10H10FN
Molecular Weight: 163.19
InChI: InChI=1/C10H10FN/c1-6-7(2)12-10-4-3-8(11)5-9(6)10/h3-5,12H,1-2H3
Molecular Structure: (C10H10FN) Indole,5-fluoro-2,3-dimethyl- (6CI,7CI,8CI);5-Fluoro-2,3-dimethylindole;
Properties
Density:1.177 g/cm3
Refractive index:1.611
Specification:

The cas register number of 2,3-Dimethyl-5-fluoroindole is 526-47-6. It also can be called as 1H-indole, 5-fluoro-2,3-dimethyl- and the Systematic name about this chemical is 5-fluoro-2,3-dimethyl-1H-indole.

Physical properties about 2,3-Dimethyl-5-fluoroindole are: (1)ACD/LogP: 3.11; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 4.93Å2; (7)Index of Refraction: 1.611; (8)Molar Refractivity: 48.17 cm3; (9)Molar Volume: 138.6 cm3; (10)Surface Tension: 42 dyne/cm; (11)Density: 1.177 g/cm3; (12)Flash Point: 127.6 °C; (13)Enthalpy of Vaporization: 50.53 kJ/mol; (14)Boiling Point: 287.3 °C at 760 mmHg; (15)Vapour Pressure: 0.00433 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: Fc1cc2c(cc1)nc(c2C)C
2.InChI: InChI=1/C10H10FN/c1-6-7(2)12-10-4-3-8(11)5-9(6)10/h3-5,12H,1-2H3
3.InChIKey: PMOQBVDDGHQQEM-UHFFFAOYAP
4.Std. InChI: InChI=1S/C10H10FN/c1-6-7(2)12-10-4-3-8(11)5-9(6)10/h3-5,12H,1-2H3

Safety Data