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880800-19-1

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Basic Information
CAS No.: 880800-19-1
Name: N-Biphenyl-4-yl-N',N'-diphenyl-benzene-1,4-diamine
Article Data: 6
Molecular Structure:
Molecular Structure of 880800-19-1 (N-Biphenyl-4-yl-N',N'-diphenyl-benzene-1,4-diamine)
Formula: C30H24N2
Molecular Weight: 412.534
Synonyms: 1,4-Benzenediamine,N'-[1,1'-biphenyl]-4-yl-N,N-diphenyl- (9CI);
Density: 1.172 g/cm3
Boiling Point: 593.2 °C at 760 mmHg
Flash Point: 202.3 °C
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Specification

This chemical is called 1,4-Benzenediamine, N4-[1,1'-biphenyl]-4-yl-N1,N1-diphenyl-, and it can also be named as N'-(Biphenyl-4-yl)-N,N-diphenylbenzene-1,4-diamine. With the molecular formula of C30H24N2, its molecular weight is 412.52. The CAS registry number of this chemical is 880800-19-1.

Other characteristics of the 1,4-Benzenediamine, N4-[1,1'-biphenyl]-4-yl-N1,N1-diphenyl- can be summarised as followings: (1)ACD/LogP: 8.71; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.71; (4)ACD/LogD (pH 7.4): 8.71 ; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 6; (8)Polar Surface Area: 15.27 Å2; (9)Index of Refraction: 1.687; (10)Molar Refractivity: 134.06 cm3; (11)Molar Volume: 351.9 cm3; (12)Polarizability: 53.14×10-24cm3; (13)Surface Tension: 51.9 dyne/cm; (14)Density: 1.172 g/cm3; (15)Flash Point: 202.3 °C; (16)Enthalpy of Vaporization: 88.45 kJ/mol; (17)Boiling Point: 593.2 °C at 760 mmHg; (18)Vapour Pressure: 4.82E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: c1ccccc1N(c2ccccc2)c3ccc(cc3)Nc4ccc(cc4)c5ccccc5
2.InChI: InChI=1/C30H24N2/c1-4-10-24(11-5-1)25-16-18-26(19-17-25)31-27-20-22-30(23-21-27)32(28-12-6-2-7-13-28)29-14-8-3-9-15-29/h1-23,31H
3.InChIKey:BMWFGSBSRCFWTA-UHFFFAOYAZ