Benzofuran,5-bromo-2-ethyl- (39178-60-4)

The CAS register number of 5-Bromo-2-ethylbenzofuran is 39178-60-4. It also can be called as Benzofuran,5-bromo-2-ethyl- and the systematic name about this chemical is 5-bromo-2-ethyl-1-benzofuran. It belongs to the following product categories, such as Heterocycles, Heterocyclic Compound and so on.

Physical properties about 5-Bromo-2-ethylbenzofuran are: (1)ACD/LogP: 4.48; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 1378; (5)ACD/BCF (pH 7.4): 1378; (6)ACD/KOC (pH 5.5): 6147; (7)ACD/KOC (pH 7.4): 6147; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 13.14Ų; (11)Index of Refraction: 1.607; (12)Molar Refractivity: 53.634 cm³; (13)Molar Volume: 155.346 cm³; (14)Polarizability: 21.262x10^-24cm³; (15)Surface Tension: 40.619 dyne/cm; (16)Enthalpy of Vaporization: 48.677 kJ/mol; (17)Boiling Point: 269.094 °C at 760 mmHg; (18)Vapour Pressure: 0.012 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc2cc(CC)oc2cc1
(2)InChI: InChI=1/C10H9BrO/c1-2-9-6-7-5-8(11)3-4-10(7)12-9/h3-6H,2H2,1H3
(3)InChIKey: IXCGZKOZXSKKFI-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C10H9BrO/c1-2-9-6-7-5-8(11)3-4-10(7)12-9/h3-6H,2H2,1H3
(5)Std. InChIKey: IXCGZKOZXSKKFI-UHFFFAOYSA-N