| Identification | |
| Name: | 1H-Benzimidazole,2-octyl- |
| Synonyms: | Benzimidazole,2-octyl- (6CI,7CI,8CI);2-Octyl-1H-benzimidazole;2-Octylbenzimidazole; |
| CAS: | 13060-24-7 |
| Molecular Formula: | C15H22N2 |
| Molecular Weight: | 230.35 |
| InChI: | InChI=1/C15H22N2/c1-2-3-4-5-6-7-12-15-16-13-10-8-9-11-14(13)17-15/h8-11H,2-7,12H2,1H3,(H,16,17) |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.014 |
| Refractive index: | 1.565 |
| Specification: |
The 2-Octylbenzimidazole is an organic compound with the formula C15H22N2. The systematic name of this chemical is 2-octyl-1H-benzimidazole. With the CAS registry number 13060-24-7, it is also named as 1H-Benzimidazole, 2-octyl-. Physical properties about 2-Octylbenzimidazole are: (1)ACD/LogP: 5.29; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.23; (4)ACD/LogD (pH 7.4): 5.24; (5)ACD/BCF (pH 5.5): 538.92; (6)ACD/BCF (pH 7.4): 5465.74; (7)ACD/KOC (pH 5.5): 1566.82; (8)ACD/KOC (pH 7.4): 15890.57; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 17.82 Å2; (13)Index of Refraction: 1.565; (14)Molar Refractivity: 73.96 cm3; (15)Molar Volume: 226.9 cm3; (16)Polarizability: 29.32×10-24cm3; (17)Surface Tension: 42.7 dyne/cm; (18)Density: 1.014 g/cm3; (19)Flash Point: 197.9 °C; (20)Enthalpy of Vaporization: 63.01 kJ/mol; (21)Boiling Point: 404.3 °C at 760 mmHg; (22)Vapour Pressure: 2.24E-06 mmHg at 25°C. You can still convert the following datas into molecular structure: |
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