The Benzene, 1,2-dihexyl- had CAS registry number 65910-04-5. This chemical's molecular formula is C18H30 and molecular weight is 246.43. Its systematic name is called 1,2-dihexylbenzene. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of Benzene, 1,2-dihexyl-: (1)ACD/LogP: 8.27; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8; (4)ACD/LogD (pH 7.4): 8; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 943744; (8)ACD/KOC (pH 7.4): 943744; (9)#Freely Rotating Bonds: 10; (10)Index of Refraction: 1.486; (11)Molar Refractivity: 82.414 cm3; (12)Molar Volume: 287.122 cm3; (13)Surface Tension: 31.229 dyne/cm; (14)Density: 0.858 g/cm3; (15)Flash Point: 151.852 °C; (16)Enthalpy of Vaporization: 54.807 kJ/mol; (17)Boiling Point: 328.347 °C at 760 mmHg; (18)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CCCCCCc1ccccc1CCCCCC
(2)InChI: InChI=1/C18H30/c1-3-5-7-9-13-17-15-11-12-16-18(17)14-10-8-6-4-2/h11-12,15-16H,3-10,13-14H2,1-2H3
(3)InChIKey: GVSYDCGFYSVNAX-UHFFFAOYAP
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