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CAS No.: | 31928-47-9 |
---|---|
Name: | 4-BROMO-2-CHLORO-1-IODOBENZENE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C6H3BrClI |
Molecular Weight: | 317.351 |
Synonyms: | 1-Bromo-3-chloro-4-iodobenzene;3-Chloro-4-iodobromobenzene;4-Bromo-2-chloro-1-iodobenzene;4-Bromo-2-chloroiodobenzene; |
EINECS: | -0 |
Density: | 2.272 g/cm3 |
Melting Point: | 35 °C |
Boiling Point: | 281.2 °C at 760 mmHg |
Flash Point: | 123.8 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39 |
PSA: | 0.00000 |
LogP: | 3.70710 |
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The CAS register number of Benzene,4-bromo-2-chloro-1-iodo- is 31928-47-9. It also can be called as 4-Bromo-2-chloroiodobenzene and the systematic name about this chemical is 4-bromo-2-chloro-1-iodobenzene. The molecular formula about this chemical is C6H3BrClI and the molecular weight is 317.35. It belongs to the following product categories which include Aromatic Halides (substituted); Bromine Compounds; Chlorine Compounds; Iodine Compounds and so on.
Physical properties about Benzene,4-bromo-2-chloro-1-iodo- are: (1)ACD/LogP: 4.76; (2)ACD/LogD (pH 5.5): 4.76; (3)ACD/LogD (pH 7.4): 4.76; (4)ACD/BCF (pH 5.5): 2421.55; (5)ACD/BCF (pH 7.4): 2421.55; (6)ACD/KOC (pH 5.5): 9203; (7)ACD/KOC (pH 7.4): 9203; (8)Index of Refraction: 1.663; (9)Molar Refractivity: 51.74 cm3; (10)Molar Volume: 139.6 cm3; (11)Polarizability: 20.51x10-24cm3; (12)Surface Tension: 48.8 dyne/cm; (13)Flash Point: 123.8 °C; (14)Enthalpy of Vaporization: 49.9 kJ/mol; (15)Boiling Point: 281.2 °C at 760 mmHg; (16)Vapour Pressure: 0.00617 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(Br)ccc1I
(2)InChI: InChI=1/C6H3BrClI/c7-4-1-2-6(9)5(8)3-4/h1-3H
(3)InChIKey: OHHKQBZOURGNLR-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C6H3BrClI/c7-4-1-2-6(9)5(8)3-4/h1-3H
(5)Std. InChIKey: OHHKQBZOURGNLR-UHFFFAOYSA-N