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CAS No.: | 202925-04-0 |
---|---|
Name: | 2-Chloro-3,5-dibromo-1-fluorobenzene |
Molecular Structure: | |
Formula: | C6H2Br2ClF |
Molecular Weight: | 288.34 |
Synonyms: | 1,5-dibromo-2-chloro-3-fluorobenzene;1-Chloro-2,4-dibromo-6-fluorobenzene; |
EINECS: | 604-604-1 |
Density: | 2.089 g/cm3 |
Melting Point: | 85-87 °C |
Boiling Point: | 253.6 °C at 760 mmHg |
Flash Point: | 107.2 °C |
Appearance: | Clear colourless to light yellow liquid |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 24/25 |
PSA: | 0.00000 |
LogP: | 4.00410 |
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The CAS register number of 2-Chloro-3,5-dibromo-1-fluorobenzene is 202925-04-0. It also can be called as 1-Chloro-2,4-dibromo-6-fluorobenzene and the systematic name about this chemical is 1,5-dibromo-2-chloro-3-fluorobenzene. The molecular formula about this chemical is C6H2Br2ClF and the molecular weight is 288.34. It belongs to the following product categories which include Bromine Compounds; Chlorine Compounds; Fluorine Compounds and so on. This chemical is irritating to eyes, respiratory system and skin. When you are using it, please avoid contact with skin and eyes.
Physical properties about 2-Chloro-3,5-dibromo-1-fluorobenzene are: (1)ACD/LogP: 4.30; (2)ACD/LogD (pH 5.5): 4.3; (3)ACD/LogD (pH 7.4): 4.3; (4)ACD/BCF (pH 5.5): 1091.19; (5)ACD/BCF (pH 7.4): 1091.19; (6)ACD/KOC (pH 5.5): 5201.5; (7)ACD/KOC (pH 7.4): 5201.5 ; (8)Index of Refraction: 1.589; (9)Molar Refractivity: 46.52 cm3; (10)Molar Volume: 137.9 cm3; (11)Polarizability: 18.44x10-24cm3; (12)Surface Tension: 42 dyne/cm; (13)Flash Point: 107.2 °C; (14)Enthalpy of Vaporization: 47.11 kJ/mol; (15)Boiling Point: 253.6 °C at 760 mmHg; (16)Vapour Pressure: 0.0289 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(Br)cc(Br)c1Cl
(2)InChI: InChI=1/C6H2Br2ClF/c7-3-1-4(8)6(9)5(10)2-3/h1-2H
(3)InChIKey: WRJXIIFHUQBLSW-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C6H2Br2ClF/c7-3-1-4(8)6(9)5(10)2-3/h1-2H
(5)Std. InChIKey: WRJXIIFHUQBLSW-UHFFFAOYSA-N