2,5-Dibenzoyl-1,4-phenylenediamine supplier

Name
2,5-Dibenzoyl-1,4-phenylenediamine
EINECS
CAS No. 38869-82-8
Density 1.264 g/cm³
Solubility
Melting Point
Formula C₂₀H₁₆N₂O₂
Boiling Point 592.8 °C at 760 mmHg
Molecular Weight 316.359
Flash Point 312.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,1'-(2,5-Diamino-1,4-phenylene)bis[1-phenyl-Methanone;(2,5-Diamino-4-benzoyl-phenyl)-phenyl-methanone;
PSA 86.18000
LogP 4.47540

2,5-Dibenzoyl-1,4-phenylenediamine Specification

The 2,5-Dibenzoyl-1,4-phenylenediamine, with the CAS registry number 38869-82-8, is also known as 1,1'-(2,5-Diamino-1,4-phenylene)bis[1-phenyl-Methanone. This chemical's molecular formula is C₂₀H₁₆N₂O₂ and molecular weight is 316.35. What's more, its systematic name is (2,5-diamino-4-benzoyl-phenyl)-phenyl-methanone.

Physical properties of 2,5-Dibenzoyl-1,4-phenylenediamine are: (1)ACD/LogP: 4.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.17; (4)ACD/LogD (pH 7.4): 4.17; (5)ACD/BCF (pH 5.5): 867.35; (6)ACD/BCF (pH 7.4): 867.39; (7)ACD/KOC (pH 5.5): 4413.19; (8)ACD/KOC (pH 7.4): 4413.39; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 86.18 Å²; (13)Index of Refraction: 1.677; (14)Molar Refractivity: 94.31 cm³; (15)Molar Volume: 250.2 cm³; (16)Polarizability: 37.38×10^-24cm³; (17)Surface Tension: 60.6 dyne/cm; (18)Density: 1.264 g/cm³; (19)Flash Point: 312.3 °C; (20)Enthalpy of Vaporization: 88.39 kJ/mol; (21)Boiling Point: 592.8 °C at 760 mmHg; (22)Vapour Pressure: 5.05E-14 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)C(=O)c2cc(c(cc2N)C(=O)c3ccccc3)N
(2)InChI: InChI=1S/C20H16N2O2/c21-17-12-16(20(24)14-9-5-2-6-10-14)18(22)11-15(17)19(23)13-7-3-1-4-8-13/h1-12H,21-22H2
(3)InChIKey: KHEYSIXPWQEYOU-UHFFFAOYSA-N

Product Name

2,5-Dibenzoyl-1,4-phenylenediamine

2,5-Dibenzoyl-1,4-phenylenediamine Specification

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