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2556-46-9

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Basic Information
CAS No.: 2556-46-9
Name: N,N'-DIPHENYLBENZAMIDINE
Article Data: 65
Molecular Structure:
Molecular Structure of 2556-46-9 (N,N'-DIPHENYLBENZAMIDINE)
Formula: C19H16N2
Molecular Weight: 272.349
Synonyms: N,N1-Diphenylbenzamidine;N,N'-Bis(phenyl)benzamidine;N,N'-Diphenylbenzamidine;N1,N2-Diphenylbenzamidine;
EINECS: 219-872-0
Density: 1.03 g/cm3
Melting Point: 125-129 °C
Boiling Point: 441.6 °C at 760 mmHg
Flash Point: 220.9 °C
Hazard Symbols: HarmfulXn
Risk Codes: 22
PSA: 24.39000
LogP: 4.95000
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Specification

The Benzenecarboximidamide,N,N'-diphenyl-, with the CAS registry number 2556-46-9, is also known as N,N'-Diphenylbenzamidine. It belongs to the product categories of Imines/Amidines; Nitrogen Compounds; Organic Building Blocks. This chemical's molecular formula is C19H16N2 and molecular weight is 272.34. Its EINECS registry number is 219-872-0. What's more, its IUPAC name is N,N'-Diphenylbenzenecarboximidamide.

Physical properties about Benzenecarboximidamide,N,N'-diphenyl are: (1)ACD/LogP: 5.12; (2)#of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 3.47; (4)ACD/LogD (pH 7.4): 4.82; (5)ACD/BCF (pH 5.5): 101.76; (6)ACD/BCF (pH 7.4): 2303.58; (7)ACD/KOC (pH 5.5): 323.04; (8)ACD/KOC (pH 7.4): 7312.69; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 15.6 Å2; (13)Index of Refraction: 1.59; (14)Molar Refractivity: 88.57 cm3; (15)Molar Volume: 262.3 cm3; (16)Polarizability: 35.11×10-24cm3; (17)Surface Tension: 40.8 dyne/cm; (18)Density: 1.03 g/cm3; (19)Flash Point: 220.9 °C; (20)Enthalpy of Vaporization: 69.9 kJ/mol; (21)Boiling Point: 441.6 °C at 760 mmHg; (22)Vapour Pressure: 5.35E-08 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. It is harmful if it is swallowed.

You can still convert the following datas into molecular structure:
(1) SMILES: N(=C(/Nc1ccccc1)c2ccccc2)\c3ccccc3
(2) InChI: InChI=1/C19H16N2/c1-4-10-16(11-5-1)19(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H,(H,20,21)
(3) InChIKey: PMYWPCUIMGLRHO-UHFFFAOYAM