N,N'-Di(1-naphthyl)-4,4'-benzidine

Details:

1.Introduction of 152670-41-2

152670-41-2 is the CAS registry number of N,N'-di(1-naphthyl)-4,4'-benzidine. Its synonyms are N4,N4'-di-naphthalen-1-yl-biphenyl-4,4'-diamine ; N,N'-dinaphthyl-4,4'-diphenyldiamine; N,N'-di(1-naphthyl) benzidine; N,N'-di(1-naphthyl)benzidine N,N'-dinaphthyl-4,4'-diphenyldiamine; N,N'-di(1-naphthyl)-; 4\'-diamine; N4\'-di-naphthalen-1-yl-biphenyl-4. Its molecular formula is C32H24N2. Its molecular weight is 436.54636.

2.Properties of 152670-41-2

ACD/LogP: 8.549
# of Rule of 5 Violations: 1
ACD/LogD (pH 5.5): 8.55
ACD/LogD (pH 7.4): 8.55
ACD/BCF (pH 5.5): 1000000.00
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 5.5): 1065774.00
ACD/KOC (pH 7.4): 1065898.00
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
Polar Surface Area: 24.06?²
Index of Refraction: 1.754
Molar Refractivity: 145.279 cm³
Molar Volume: 355.031 cm³
Polarizability: 57.593 10-24cm³
Surface Tension: 56.8759994506836 dyne/cm
Density: 1.23 g/cm³
Flash Point: 400.062 °C
Enthalpy of Vaporization: 93.753 kJ/mol
Boiling Point: 634.317 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 152670-41-2

(1)InChI: InChI=1S/C32H24N2/c1-3-11-29-25(7-1)9-5-13-31(29)33-27-19-15-23(16-20-27)24-17-21-28(22-18-24)34-32-14-6-10-26-8-2-4-12-30(26)32/h1-22,33-34H
(2)InChIKey: SZDXPEWZZGNIBB-UHFFFAOYSA-N
(3)Canonical SMILES : C1=CC=C2C(=C1)C=CC=C2NC3=CC=C(C=C3)C4=CC=C(C=C4)NC5=CC=CC6=CC=CC=C65