This chemical is called [1,1'-Biphenyl]-3-acetamide,N-(2-phenylethyl)-, and it can also be named as 2-(Biphenyl-3-yl)-N-phenethylacetamide. The molecular formula of this chemical is C22H21NO. The CAS registry number of this chemical is 1131604-80-2, and its systematic name is N-phenethyl-2-(3-phenylphenyl)acetamide.
Other characteristics of the [1,1'-Biphenyl]-3-acetamide,N-(2-phenylethyl)- can be summarised as followings: (1)ACD/LogP: 4.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.984; (4)ACD/LogD (pH 7.4): 4.984; (5)ACD/BCF (pH 5.5): 3612.116; (6)ACD/BCF (pH 7.4): 3612.118; (7)ACD/KOC (pH 5.5): 12252.922; (8)ACD/KOC (pH 7.4): 12252.936; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 29.1 Å2; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 97.772 cm3; (15)Molar Volume: 287.186 cm3; (16)Polarizability: 38.76×10-24 cm3; (17)Surface Tension: 44.554 dyne/cm; (18)Density: 1.098 g/cm3; (19)Flash Point: 334.047 °C; (20)Enthalpy of Vaporization: 83.218 kJ/mol; (21)Boiling Point: 551.775 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: c1ccc(cc1)CCNC(=O)Cc2cccc(c2)c3ccccc3
2.InChI: InChI=1/C22H21NO/c24-22(23-15-14-18-8-3-1-4-9-18)17-19-10-7-13-21(16-19)20-11-5-2-6-12-20/h1-13,16H,14-15,17H2,(H,23,24)
3.InChIKey: UXWSQDFAFHKXLG-UHFFFAOYAE
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