Pyrimidine,4-bromo-6-(trifluoromethyl)- supplier

Name
4-BROMO-6-(TRIFLUOROMETHYL)PYRIMIDINE
EINECS
CAS No. 785777-89-1
Density 1.807 g/cm³
Solubility
Melting Point
Formula C₅H₂BrF₃N₂
Boiling Point 189.4 °C at 760 mmHg
Molecular Weight 226.983
Flash Point 68.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-6-(trifluoromethyl)pyrimidine;4-Bromo-6-trifluoromethylpyrimidine;
PSA 25.78000
LogP 2.25790

Pyrimidine,4-bromo-6-(trifluoromethyl)- Specification

The Pyrimidine,4-bromo-6-(trifluoromethyl)- is an organic compound with the formula C₅H₂BrF₃N₂. With the CAS registry number 785777-89-1, the systematic name of this chemical is 4-bromo-6-(trifluoromethyl)pyrimidine.

Physical properties about Pyrimidine,4-bromo-6-(trifluoromethyl)- are: (1)ACD/LogP: 0.70; (2)ACD/LogD (pH 5.5): 0.7; (3)ACD/LogD (pH 7.4): 0.7; (4)ACD/BCF (pH 5.5): 2.01; (5)ACD/BCF (pH 7.4): 2.01; (6)ACD/KOC (pH 5.5): 57.42; (7)ACD/KOC (pH 7.4): 57.42; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78 Å²; (10)Index of Refraction: 1.471; (11)Molar Refractivity: 35.1 cm³; (12)Molar Volume: 125.5 cm³; (13)Polarizability: 13.9×10^-24cm³; (14)Surface Tension: 34 dyne/cm; (15)Density: 1.807 g/cm³; (16)Flash Point: 68.3 °C; (17)Enthalpy of Vaporization: 40.82 kJ/mol; (18)Boiling Point: 189.4 °C at 760 mmHg; (19)Vapour Pressure: 0.79 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ncnc(c1)C(F)(F)F
(2)InChI: InChI=1/C5H2BrF3N2/c6-4-1-3(5(7,8)9)10-2-11-4/h1-2H
(3)InChIKey: AGUIEFSLABIYOT-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C5H2BrF3N2/c6-4-1-3(5(7,8)9)10-2-11-4/h1-2H
(5)Std. InChIKey: AGUIEFSLABIYOT-UHFFFAOYSA-N

Product Name

4-BROMO-6-(TRIFLUOROMETHYL)PYRIMIDINE

Pyrimidine,4-bromo-6-(trifluoromethyl)- Specification

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