The Ethene, 1-bromo-2-fluoro- (9CI), with the CAS registry number of 460-11-7, is also known as 1-Bromo-2-fluoroethene. This chemical's molecular formula is C2H2BrF and molecular weight is 124.94. What's more, its systematic name is called (E)-1-Bromo-2-fluoroethene.
Physical properties about Ethene, 1-bromo-2-fluoro- (9CI) are: (1)ACD/LogP: 1.65; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.65; (4)ACD/LogD (pH 7.4): 1.65; (5)ACD/BCF (pH 5.5): 10.52; (6)ACD/BCF (pH 7.4): 10.52; (7)ACD/KOC (pH 5.5): 187.54; (8)ACD/KOC (pH 7.4): 187.54; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.435; (14)Molar Refractivity: 19.26 cm3; (15)Molar Volume: 73.7 cm3; (16)Surface Tension: 22.4 dyne/cm; (17)Density: 1.693 g/cm3; (18)Enthalpy of Vaporization: 26.9 kJ/mol; (19)Boiling Point: 35.6 °C at 760 mmHg; (20)Vapour Pressure: 519 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical is flammable, and it may catch fire in contact with an ignition source. Hence, keep it away from sources of ignition.
You can still convert the following datas into molecular structure:
(1) SMILES: Br[C@H]=CF
(2) InChI: InChI=1/C2H2BrF/c3-1-2-4/h1-2H/b2-1+
(3) InChIKey: JNODEIRSLUOUMY-OWOJBTEDBT
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