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Name |
Benzene,1-bromo-4-[(1,2,2-trifluoroethenyl)oxy]- |
EINECS | N/A |
CAS No. | 134151-77-2 | Density | 1.625 g/cm3 |
PSA | 9.23000 | LogP | 3.86300 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H4BrF3O | Boiling Point | 185.9 °C at 760 mmHg |
Molecular Weight | 253.018 | Flash Point | 81.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
4-Bromophenyl trifluorovinyl ether; |
Article Data | 10 |
The Benzene, 1-bromo-4-[(1, 2, 2-trifluoroethenyl)oxy]-, with the CAS registry number 134151-77-2, is also known as 4-Bromophenyl trifluorovinyl ether. This chemical's molecular formula is C8H4BrF3O and molecular weight is 253.016. What's more, its systematic name is 1-Bromo-4-[(trifluoroethenyl)oxy]benzene.
Physical properties about Benzene, 1-bromo-4-[(1, 2, 2-trifluoroethenyl)oxy]- are: (1)ACD/LogP: 4.22; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.22; (4)ACD/LogD (pH 7.4): 4.22; (5)ACD/BCF (pH 5.5): 947.03; (6)ACD/BCF (pH 7.4): 947.03; (7)ACD/KOC (pH 5.5): 4699.83; (8)ACD/KOC (pH 7.4): 4699.83; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.496; (14)Molar Refractivity: 45.48 cm3; (15)Molar Volume: 155.6 cm3; (16)Polarizability: 18.03×10-24 cm3; (17)Surface Tension: 29.3 dyne/cm; (18)Density: 1.625 g/cm3; (19)Flash Point: 81.7 °C; (20)Enthalpy of Vaporization: 40.49 kJ/mol; (21)Boiling Point: 185.9 °C at 760 mmHg; (22)Vapour Pressure: 0.933 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc(OC(\F)=C(/F)F)cc1
(2) InChI: InChI=1/C8H4BrF3O/c9-5-1-3-6(4-2-5)13-8(12)7(10)11/h1-4H
(3) InChIKey: KGNLXBIRBHMRHB-UHFFFAOYAZ