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The 1-Methoxy-4-n-pentylbenzene, with the CAS registry number 20056-58-0, is also known as Anisole, p-pentyl-. This chemical's molecular formula is C12H18O and molecular weight is 178.27. Its systematic name is called 1-methoxy-4-pentylbenzene.
Physical properties of 1-Methoxy-4-n-pentylbenzene: (1)ACD/LogP: 4.72; (2)ACD/LogD (pH 5.5): 4.72; (3)ACD/LogD (pH 7.4): 4.72; (4)ACD/BCF (pH 5.5): 2272.68; (5)ACD/BCF (pH 7.4): 2272.68; (6)ACD/KOC (pH 5.5): 8794.41; (7)ACD/KOC (pH 7.4): 8794.41; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.487; (11)Molar Refractivity: 56.37 cm3; (12)Molar Volume: 195.7 cm3; (13)Surface Tension: 30.4 dyne/cm; (14)Density: 0.91 g/cm3; (15)Flash Point: 108.1 °C; (16)Enthalpy of Vaporization: 46.8 kJ/mol; (17)Boiling Point: 250.5 °C at 760 mmHg; (18)Vapour Pressure: 0.0343 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(c1ccc(cc1)CCCCC)C
(2)InChI: InChI=1/C12H18O/c1-3-4-5-6-11-7-9-12(13-2)10-8-11/h7-10H,3-6H2,1-2H3
(3)InChIKey: GLWHNBIQKCPVTP-UHFFFAOYAB