The 1-[(E)-2-(4-Methylphenyl)ethenyl]-4-nitro-benzene, with the CAS registry number 7560-35-2 , is also known as 1-Methyl-4-(2-(4-nitrophenyl)ethenyl)benzene. This chemical's molecular formula is C15H13NO2 and molecular weight is 239.26922. What's more, both its IUPAC name and systematic name are the same which is called 1-Methyl-4-[(E)-2-(4-nitrophenyl)ethenyl]benzene.
Physical properties about 1-[(E)-2-(4-Methylphenyl)ethenyl]-4-nitro-benzene are: (1)ACD/LogP: 5.07; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 45.82 Å2; (7)Index of Refraction: 1.67; (8)Molar Refractivity: 75.01 cm3; (9)Molar Volume: 200.7 cm3; (10)Surface Tension: 50.4 dyne/cm; (11)Density: 1.191 g/cm3; (12)Flash Point: 159.5 °C; (13)Enthalpy of Vaporization: 58.13 kJ/mol; (14)Boiling Point: 359.5 °C at 760 mmHg; (15)Vapour Pressure: 4.9E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
SMILES: [O-][N+](=O)c2ccc(/C=C/c1ccc(cc1)C)cc2
(2) InChI: InChI=1S/C15H13NO2/c1-12-2-4-13(5-3-12)6-7-14-8-10-15(11-9-14)16(17)18/
h2-11H,1H3/b7-6+
(3) InChIKey: UBQLCQJBQYBLHV-VOTSOKGWSA-N
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