1H-Indole,7-bromo-5-chloro- (292636-08-9)

The 7-Bromo-5-chloroindole, with the CAS registry number 292636-08-9, is also known as 1H-Indole, 7-bromo-5-chloro-. This chemical's molecular formula is C₈H₅BrClN and molecular weight is 230.49. Its systematic name is called 7-Bromo-5-chloro-1H-indole.

Physical properties about this chemical are: (1)ACD/LogP: 3.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.65; (4)ACD/LogD (pH 7.4): 3.65; (5)ACD/BCF (pH 5.5): 349.47; (6)ACD/BCF (pH 7.4): 349.47; (7)ACD/KOC (pH 5.5): 2302.39; (8)ACD/KOC (pH 7.4): 2302.39; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.715; (13)Molar Refractivity: 51.11 cm³; (14)Molar Volume: 130 cm³; (15)Surface Tension: 56.9 dyne/cm; (16)Density: 1.772 g/cm³; (17)Flash Point: 164.4 °C; (18)Enthalpy of Vaporization: 56.91 kJ/mol; (19)Boiling Point: 348.1 °C at 760 mmHg; (20)Vapour Pressure: 0.000103 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c[nH]c2c1cc(cc2Br)Cl
(2)InChI: InChI=1/C8H5BrClN/c9-7-4-6(10)3-5-1-2-11-8(5)7/h1-4,11H
(3)InChIKey: CBQDZTGRYHTJRO-UHFFFAOYAW