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[1,1'-Biphenyl]-3,3'-diamine,N3,N3,N3',N3'-tetrakis(4-methylphenyl)- (161485-60-5)

Identification
Name:[1,1'-Biphenyl]-3,3'-diamine,N3,N3,N3',N3'-tetrakis(4-methylphenyl)-
Synonyms:[1,1'-Biphenyl]-3,3'-diamine,N,N,N',N'-tetrakis(4-methylphenyl)- (9CI);N,N,N',N'-Tetrakis(4-methylphenyl)-[1,1'-biphenyl]-3,3'-diamine;
CAS:161485-60-5
Molecular Formula: C40H36N2
Molecular Weight: 544.73
InChI: InChI=1/C40H36N2/c1-29-5-17-35(18-6-29)41(36-19-7-30(2)8-20-36)39-25-13-33(14-26-39)34-15-27-40(28-16-34)42(37-21-9-31(3)10-22-37)38-23-11-32(4)12-24-38/h5-28H,1-4H3
Molecular Structure: (C40H36N2) [1,1'-Biphenyl]-3,3'-diamine,N,N,N',N'-tetrakis(4-methylphenyl)- (9CI);N,N,N',N'-Tetrakis(4-methylph...
Properties
Flash Point: 310.749°C
Boiling Point: 701.741°C at 760 mmHg
Density:1.129
Refractive index:1.659
Specification:

The N,N,N',N'-Tetrakis(4-methylphenyl)benzidine with cas registry number of 161485-60-5, belongs to the following product categorie: electronic. And it is also called N,N,N',N'-Tetrakis(4-methylphenyl)benzidine.

Physical properties about this chemical are: (1)ACD/LogP: 14.14; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 13; (4)ACD/LogD (pH 7.4): 13; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.659; (14)Molar Refractivity: 177.832 cm3; (15)Molar Volume: 482.139 cm3; (16)Polarizability: 70.498×10-24cm3; (17)Surface Tension: 48.61 dyne/cm; (18)Enthalpy of Vaporization: 102.71 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: c6c(N(c4ccc(c3ccc(N(c1ccc(cc1)C)c2ccc(cc2)C)cc3)cc4)c5ccc(cc5)C)ccc(c6)C;
(2)InChI: InChI=1/C40H36N2/c1-29-5-17-35(18-6-29)41(36-19-7-30(2)8-20-36)39-25-13-33(14-26-39)34-15-27-40(28-16-34)42(37-21-9-31(3)10-22-37)38-23-11-32(4)12-24-38/h5-28H,1-4H3;
(3)InChIKey: MVIXNQZIMMIGEL-UHFFFAOYAW;
(4)Std. InChI: InChI=1S/C40H36N2/c1-29-5-17-35(18-6-29)41(36-19-7-30(2)8-20-36)39-25-13-33(14-26-39)34-15-27-40(28-16-34)42(37-21-9-31(3)10-22-37)38-23-11-32(4)12-24-38/h5-28H,1-4H3;
(5)Std. InChIKey: MVIXNQZIMMIGEL-UHFFFAOYSA-N

Flash Point: 310.749°C
Safety Data
 

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