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CAS No.: | 151412-02-1 |
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Name: | 2,3,6-Trifluorobenzyl bromide |
Molecular Structure: | |
Formula: | C7H4BrF3 |
Molecular Weight: | 225.008 |
Synonyms: | 2-(Bromomethyl)-1,3,4-trifluorobenzene;2-Bromomethyl-1,3,4-trifluorobenzene;α-Bromo-2,3,6-trifluorotoluene; |
Density: | 1.71 g/cm3 |
Melting Point: | 114°C (dec.) |
Boiling Point: | 183.961 °C at 760 mmHg |
Flash Point: | 71.448 °C |
Hazard Symbols: | C |
Risk Codes: | 34 |
Safety: | 26-27-36/37/39-45 |
PSA: | 0.00000 |
LogP: | 2.99880 |
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The Benzene,2-(bromomethyl)-1,3,4-trifluoro- is an organic compound with the formula C7H4BrF3. The IUPAC name of this chemical is 2-(Bromomethyl)-1,3,4-trifluorobenzene. With the CAS registry number 151412-02-1, it is also named as 2,3,6-Trifluorobenzylbromide. The product's categories are Aryl; C7; Halogenated Hydrocarbons. Besides, it should be stored at 2-8 °C.
Physical properties about Benzene,2-(bromomethyl)-1,3,4-trifluoro- are: (1)ACD/LogP: 3.09; (2)ACD/LogD (pH 5.5): 3.09; (3)ACD/LogD (pH 7.4): 3.09; (4)ACD/BCF (pH 5.5): 131.21; (5)ACD/BCF (pH 7.4): 131.21; (6)ACD/KOC (pH 5.5): 1141.94; (7)ACD/KOC (pH 7.4): 1141.94; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.502; (10)Molar Refractivity: 38.88 cm3; (11)Molar Volume: 131.5 cm3; (12)Polarizability: 15.41×10-24 cm3; (13)Surface Tension: 33.9 dyne/cm; (14)Density: 1.71 g/cm3; (15)Flash Point: 71.4 °C; (16)Enthalpy of Vaporization: 40.3 kJ/mol; (17)Boiling Point: 184 °C at 760 mmHg; (18)Vapour Pressure: 1.03 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
It is causes burns. When you are using it, wear suitable protective clothing, gloves and eye/face protection, and take off immediately all contaminated clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H4BrF3/c8-3-4-5(9)1-2-6(10)7(4)11/h1-2H,3H2
(2)InChIKey: JPBWEVKHPSNBCE-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C7H4BrF3/c8-3-4-5(9)1-2-6(10)7(4)11/h1-2H,3H2
(4)Std. InChIKey: JPBWEVKHPSNBCE-UHFFFAOYSA-N