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Ethanamine,2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethyl-

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Name

Ethanamine,2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethyl-

EINECS N/A
CAS No. 84203-09-8 Density 1.135 g/cm3
PSA 41.15000 LogP 5.35110
Solubility N/A Melting Point N/A
Formula C25H25N3O Boiling Point 584.7 °C at 760 mmHg
Molecular Weight 383.493 Flash Point 307.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 84203-09-8 (Trifenagrel) Hazard Symbols N/A
Synonyms

BW 325U;Trifenagrel;2-[2-(4,5-Diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethylethanamine;2-(o-(2-(Dimethylamino)ethoxy)phenyl)-4,5-diphenylimidazole;

Article Data 7

Ethanamine,2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethyl- Specification

The Ethanamine,2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethyl-, with the CAS registry number 84203-09-8, is also known as 2-(o-(2-(Dimethylamino)ethoxy)phenyl)-4,5-diphenylimidazole. This chemical's molecular formula is C25H25N3O and molecular weight is 383.49. What's more, its systematic name is 2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethylethanamine. Its classification code is Antithrombotic. 

Physical properties of Ethanamine,2-[2-(4,5-diphenyl-1H-imidazol-2-yl)phenoxy]-N,N-dimethyl- are: (1)ACD/LogP: 4.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.39; (4)ACD/LogD (pH 7.4): 3.26; (5)ACD/BCF (pH 5.5): 1.19; (6)ACD/BCF (pH 7.4): 88.49; (7)ACD/KOC (pH 5.5): 5.06; (8)ACD/KOC (pH 7.4): 377.37; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 30.29 Å2; (13)Index of Refraction: 1.608; (14)Molar Refractivity: 116.85 cm3; (15)Molar Volume: 337.6 cm3; (16)Polarizability: 46.32×10-24cm3; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.135 g/cm3; (19)Flash Point: 307.4 °C; (20)Enthalpy of Vaporization: 87.36 kJ/mol; (21)Boiling Point: 584.7 °C at 760 mmHg; (22)Vapour Pressure: 1.18E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C)CCOC1=CC=CC=C1C2=NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4
(2)InChI: InChI=1S/C25H25N3O/c1-28(2)17-18-29-22-16-10-9-15-21(22)25-26-23(19-11-5-3-6-12-19)24(27-25)20-13-7-4-8-14-20/h3-16H,17-18H2,1-2H3,(H,26,27)
(3)InChIKey: KGVYOGLFOPNPDJ-UHFFFAOYSA-N

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