2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole supplier

Name
2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole
EINECS
CAS No. 81654-02-6
Density 2.316 g/cm³
Solubility
Melting Point 166-168 °C
Formula C₄HBr₂F₃N₂
Boiling Point 313.365 °C at 760 mmHg
Molecular Weight 293.87
Flash Point 143.318 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 1H-Imidazole,2,4-dibromo-5-(trifluoromethyl)- (9CI);
PSA 28.68000
LogP 2.95350

2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole Specification

The 2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole, with CAS registry number 81654-02-6, belongs to the following product category: Heterocycle. It has the systematic name of 2,4-dibromo-5-(trifluoromethyl)-1H-imidazole. Besides this, it is also called 1H-imidazole, 2,4-dibromo-5-(trifluoromethyl)-. And the chemical formula of this chemical is C₄HBr₂F₃N₂.

Physical properties of 2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole: (1)ACD/LogP: 1.71; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 18; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 253; (8)ACD/KOC (pH 7.4): 18; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.68 Å²; (13)Index of Refraction: 1.529; (14)Molar Refractivity: 39.138 cm³; (15)Molar Volume: 126.86 cm³; (16)Polarizability: 15.515×10^-24cm³; (17)Surface Tension: 40.095 dyne/cm; (18)Enthalpy of Vaporization: 55.444 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1nc(Br)nc1C(F)(F)F
(2)InChI: InChI=1/C4HBr2F3N2/c5-2-1(4(7,8)9)10-3(6)11-2/h(H,10,11)
(3)InChIKey: JOTAIPGEZUZEEJ-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C4HBr2F3N2/c5-2-1(4(7,8)9)10-3(6)11-2/h(H,10,11)
(5)Std. InChIKey: JOTAIPGEZUZEEJ-UHFFFAOYSA-N

Product Name

2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole

2,4-Dibromo-5-(trifluoromethyl)-1H-imidazole Specification

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