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CAS No.: | 38573-88-5 |
---|---|
Name: | 1-Bromo-2,3-difluorobenzene |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C6H3BrF2 |
Molecular Weight: | 192.991 |
Synonyms: | 2,3-Difluorobrmorobenzene; |
EINECS: | -0 |
Density: | 1.692 g/cm3 |
Boiling Point: | 158.3 °C at 760 mmHg |
Flash Point: | 49.5 °C |
Appearance: | Clear colorless to peach liquid |
Hazard Symbols: | Xi, F |
Risk Codes: | 36/37/38 |
Safety: | 26-36/37/39-37/39 |
PSA: | 0.00000 |
LogP: | 2.72730 |
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The 1-Bromo-2,3-difluorobenzene is an organic compound with the formula C6H3BrF2. The systematic name of this chemical is 1-bromo-2,3-difluorobenzene. With the CAS registry number 38573-88-5, it is also named as Benzene, 1-bromo-2,3-difluoro-. The product's categories are Other fluorin-contained compounds; Fluorobenzene Series; Fluorobenzene; Aromatic Halides (substituted); Miscellaneous; Aryl; C6; Halogenated Hydrocarbons. Besides, it is a clear colorless to peach liquid, which should be stored in a closed cool and dry place.
Physical properties about 1-Bromo-2,3-difluorobenzene are: (1)ACD/LogP: 2.91; (2)ACD/LogD (pH 5.5): 2.91; (3)ACD/LogD (pH 7.4): 2.91; (4)ACD/BCF (pH 5.5): 95.28; (5)ACD/BCF (pH 7.4): 95.28; (6)ACD/KOC (pH 5.5): 908.17; (7)ACD/KOC (pH 7.4): 908.17; (8)Index of Refraction: 1.506; (9)Molar Refractivity: 33.93 cm3; (10)Molar Volume: 114 cm3; (11)Polarizability: 13.45×10-24cm3; (12)Surface Tension: 32.3 dyne/cm; (13)Density: 1.692 g/cm3; (14)Flash Point: 49.5 °C; (15)Enthalpy of Vaporization: 37.87 kJ/mol; (16)Boiling Point: 158.3 °C at 760 mmHg; (17)Vapour Pressure: 3.43 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 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: Fc1cccc(Br)c1F
(2)InChI: InChI=1/C6H3BrF2/c7-4-2-1-3-5(8)6(4)9/h1-3H
(3)InChIKey: RKWWASUTWAFKHA-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H3BrF2/c7-4-2-1-3-5(8)6(4)9/h1-3H
(5)Std. InChIKey: RKWWASUTWAFKHA-UHFFFAOYSA-N