The CAS registry number of Benzo[b]thiophene-3-acetonitrile,5-bromo- is 23799-61-3. This chemical's molecular formula is C₁₀H₆BrNS and molecular weight is 252.1303. What's more, its systematic name is called (5-Bromo-1-benzothiophen-3-yl)acetonitrile.

Physical properties about this chemical are: (1)ACD/LogP: 4.38; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.38; (4)ACD/LogD (pH 7.4): 4.38; (5)ACD/BCF (pH 5.5): 1260.77; (6)ACD/BCF (pH 7.4): 1260.77; (7)ACD/KOC (pH 5.5): 5768.12; (8)ACD/KOC (pH 7.4): 5768.12; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 52.03 Å²; (13)Index of Refraction: 1.693; (14)Molar Refractivity: 59.63 cm³; (15)Molar Volume: 155.4 cm³; (16)Polarizability: 23.64×10^-24 cm³; (17)Surface Tension: 58.4 dyne/cm; (18)Density: 1.622 g/cm³; (19)Flash Point: 192.2 °C; (20)Enthalpy of Vaporization: 64.42 kJ/mol; (21)Boiling Point: 394.2 °C at 760 mmHg; (22)Vapour Pressure: 2.02E-06 mmHg at 25 °C.

Preparation of Benzo[b]thiophene-3-acetonitrile,5-bromo-: this chemical can be prepared by 5-Bromo-3-bromomethyl-benzo[b]thiophene and Hydrocyanic acid; sodium salt.

This reaction needs reagent Dimethylsulfoxide at temperature of 60 °C. The reaction time is 1 hour. The yield is 70 %.

Uses of Benzo[b]thiophene-3-acetonitrile,5-bromo-: it is used to produce other chemicals. For example, it is used to produce 2-(5-Bromo-benzo[b]thiophen-3-yl)-ethylamine; hydrochloride.

The reaction needs reagents Borane-tetrahydrofuran complex, Hydrochloric acid and solvent Tetrahydrofuran. This reaction will occur at the condition of heating for 3 hours. The yield is 70 %.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc2c(cc1)scc2CC#N
(2) InChI: InChI=1/C10H6BrNS/c11-8-1-2-10-9(5-8)7(3-4-12)6-13-10/h1-2,5-6H,3H2
(3) InChIKey: FXPSKDXIAHKGJM-UHFFFAOYAK