5-Bromo-4-(trifluoromethyl)pyrimidine supplier

Name
5-Bromo-4-(trifluoromethyl)pyrimidine
EINECS
CAS No. 785777-88-0
Density 1.807 g/cm³
Solubility
Melting Point -4--2 °C
Formula C₅H₂BrF₃N₂
Boiling Point 201.7 °C at 760 mmHg
Molecular Weight 226.9819896
Flash Point 75.8 °C
Transport Information
Appearance
Safety 36/37
Risk Codes 20/21/22
Molecular Structure
Hazard Symbols
Synonyms pyrimidine,5-bromo-4-(trifluoromethyl)-;
PSA 25.78000
LogP 2.25790

5-Bromo-4-(trifluoromethyl)pyrimidine Specification

The 5-Bromo-4-(trifluoromethyl)pyrimidine with CAS registry number of 785777-88-0 also called pyrimidine,5-bromo-4-(trifluoromethyl)-. In addition, the formula is C₅H₂BrF₃N₂ and the molecular weight is 226.9819896. It should be stored in a cool environment.

Physical properties about this chemical are: (1)ACD/LogP: 1.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.12; (4)ACD/LogD (pH 7.4): 1.12; (5)ACD/BCF (pH 5.5): 4.17; (6)ACD/BCF (pH 7.4): 4.17; (7)ACD/KOC (pH 5.5): 96.77; (8)ACD/KOC (pH 7.4): 96.77; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å²; (13)Index of Refraction: 1.471; (14)Molar Refractivity: 35.1 cm³; (15)Molar Volume: 125.5 cm³; (16)Polarizability: 13.91 ×10^-24cm³; (17)Surface Tension: 34 dyne/cm; (18)Density: 1.807 g/cm³; (19)Flash Point: 75.8 °C; (20)Enthalpy of Vaporization: 42.01 kJ/mol; (21)Boiling Point: 201.7 °C at 760 mmHg; (22)Vapour Pressure: 0.43 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1ncncc1Br
(2)InChI: InChI=1/C5H2BrF3N2/c6-3-1-10-2-11-4(3)5(7,8)9/h1-2H
(3)InChIKey: XQBMNXRFVINPTJ-UHFFFAOYAO

Product Name

5-Bromo-4-(trifluoromethyl)pyrimidine

5-Bromo-4-(trifluoromethyl)pyrimidine Specification

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