The Benzene,[2-(cyclopentyloxy)ethyl]-, with the CAS registry number 238088-70-5, is also known as Cyclopentyl 2-phenylethyl ether. This chemical's molecular formula is C13H18O and molecular weight is 190.28. What's more, its systematic name is 2-(cyclopentoxy)ethylbenzene. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].
Physical properties of Benzene,[2-(cyclopentyloxy)ethyl]- are: (1)ACD/LogP: 3.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.64; (4)ACD/LogD (pH 7.4): 3.64; (5)ACD/BCF (pH 5.5): 341.93; (6)ACD/BCF (pH 7.4): 341.93; (7)ACD/KOC (pH 5.5): 2266.72; (8)ACD/KOC (pH 7.4): 2266.72; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.521; (13)Molar Refractivity: 58.84 cm3; (14)Molar Volume: 193.2 cm3; (15)Polarizability: 23.32×10-24cm3; (16)Surface Tension: 35.8 dyne/cm; (17)Density: 0.98 g/cm3; (18)Flash Point: 111.5 °C; (19)Enthalpy of Vaporization: 48.77 kJ/mol; (20)Boiling Point: 270.1 °C at 760 mmHg; (21)Vapour Pressure: 0.0116 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)CCOC2CCCC2
(2)InChI: InChI=1S/C13H18O/c1-2-6-12(7-3-1)10-11-14-13-8-4-5-9-13/h1-3,6-7,13H,4-5,8-11H2
(3)InChIKey: WVOZHIRBKFYTDG-UHFFFAOYSA-N
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