This chemical is called Benzenamine, 4-cyclohexyl-N-[4-(1-methylethyl)phenyl]-, and its systematic name is N-(4-cyclohexylphenyl)-4-isopropyl-aniline. With the molecular formula of C21H27N, its molecular weight is 293.45. The CAS registry number of this chemical is 886365-92-0.
Other characteristics of the Benzenamine, 4-cyclohexyl-N-[4-(1-methylethyl)phenyl]- can be summarised as followings: (1)ACD/LogP: 6.83; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.83; (4)ACD/LogD (pH 7.4): 6.83; (5)#H bond acceptors: 1; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 12.03 Å2; (9)Index of Refraction: 1.581; (10)Molar Refractivity: 95.67 cm3; (11)Molar Volume: 286.7 cm3; (12)Polarizability: 37.92×10-24cm3; (13)Surface Tension: 40.1 dyne/cm; (14)Density: 1.023 g/cm3; (15)Flash Point: 218.7 °C; (16)Enthalpy of Vaporization: 67.78 kJ/mol; (17)Boiling Point: 423.5 °C at 760 mmHg; (18)Vapour Pressure: 2.23E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CC(C)c1ccc(cc1)Nc2ccc(cc2)C3CCCCC3
2.InChI: InChI=1/C21H27N/c1-16(2)17-8-12-20(13-9-17)22-21-14-10-19(11-15-21)18-6-4-3-5-7-18/h8-16,18,22H,3-7H2,1-2H3
3.InChIKey: UXZMIAMPVHCAIH-UHFFFAOYAL
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