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1028647-93-9

Basic Information
CAS No.: 1028647-93-9
Name: 3-(4-Bromophenyl)-9-phenyl-9H-Carbazole
Molecular Structure:
Molecular Structure of 1028647-93-9 (3-(4-Bromophenyl)-9-phenyl-9H-Carbazole)
Formula: C24H16BrN
Molecular Weight: 398.29
Synonyms: 3-(4-bromophenyl)-N-phenyl-9H-Carbazole;
EINECS: 807-969-6
Density: 1.329 g/cm3
Melting Point: 136.0 to 140.0 °C
Boiling Point: 560.518 °C at 760 mmHg
Flash Point: 292.791 °C
Solubility:
Appearance:
Hazard Symbols:
Risk Codes:
Safety:
Transport Information:
PSA: 4.93000
LogP: 7.21320
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Specification

The 3-(4-Bromophenyl)-9-phenyl-9H-Carbazole, with the CAS registry number 1028647-93-9, has the molecular formula C24H16BrN. In addition, its molecular weight is 398.2945. Its systematic name is called 3-(4-bromophenyl)-9-phenyl-carbazole.

Physical properties of 3-(4-Bromophenyl)-9-phenyl-9H-Carbazole: (1)ACD/LogP: 8.22; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 8.218; (4)ACD/LogD (pH 7.4): 8.218; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 703901.313; (8)ACD/KOC (pH 7.4): 703901.313; (9)#H bond acceptors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.67; (12)Molar Refractivity: 111.922 cm3; (13)Molar Volume: 299.596 cm3; (14)Surface Tension: 47.057 dyne/cm; (15)Density: 1.329 g/cm3; (16)Flash Point: 292.791 °C; (17)Enthalpy of Vaporization: 84.312 kJ/mol; (18)Boiling Point: 560.518 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)n2c3ccccc3c4c2ccc(c4)c5ccc(cc5)Br
(2)InChI: InChI=1/C24H16BrN/c25-19-13-10-17(11-14-19)18-12-15-24-22(16-18)21-8-4-5-9-23(21)26(24)20-6-2-1-3-7-20/h1-16H
(3)InChIKey: JEYLGFCAZBGCMC-UHFFFAOYAI