The Benzene,1-(chloromethyl)-2,4,5-trifluoro-, with the CAS registry number 243139-71-1, is also known as 2,4,5-Trifluorobenzyl chloride. It belongs to the product categories of Halometyl; Miscellaneous. This chemical's molecular formula is C7H4ClF3 and molecular weight is 180.55487. Its IUPAC name is called 1-(chloromethyl)-2,4,5-trifluorobenzene.
Physical properties of Benzene,1-(chloromethyl)-2,4,5-trifluoro-: (1)ACD/LogP: 2.66; (2)ACD/LogD (pH 5.5): 2.66; (3)ACD/LogD (pH 7.4): 2.66; (4)ACD/BCF (pH 5.5): 61.59; (5)ACD/BCF (pH 7.4): 61.59; (6)ACD/KOC (pH 5.5): 664.61; (7)ACD/KOC (pH 7.4): 664.61; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.466; (10)Molar Refractivity: 35.99 cm3; (11)Molar Volume: 129.7 cm3; (12)Surface Tension: 30 dyne/cm; (13)Density: 1.391 g/cm3; (14)Flash Point: 63.2 °C; (15)Enthalpy of Vaporization: 39.39 kJ/mol; (16)Boiling Point: 174.5 °C at 760 mmHg; (17)Vapour Pressure: 1.61 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may destroy living tissue on contact and may cause damage to health. It is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(C(=CC(=C1F)F)F)CCl
(2)InChI: InChI=1S/C7H4ClF3/c8-3-4-1-6(10)7(11)2-5(4)9/h1-2H,3H2
(3)InChIKey: JMXPOOVDUVHJRO-UHFFFAOYSA-N
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