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CAS No.: | 64248-56-2 |
---|---|
Name: | 1-Bromo-2,6-difluorobenzene |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C6H3BrF2 |
Molecular Weight: | 192.991 |
Synonyms: | 2,6-Difluorobromobenzene;2-Bromo-1,3-difluorobenzene;2,3-difluorophenol; |
EINECS: | 264-750-2 |
Density: | 1.692 g/cm3 |
Melting Point: | 20 °C |
Boiling Point: | 149.8 °C at 760 mmHg |
Flash Point: | 53.3 °C |
Appearance: | Clean yellow liquid |
Hazard Symbols: | F, Xi |
Risk Codes: | 10-36/37/38 |
Safety: | 16-26-36/37/39 |
Transport Information: | UN 1993 3/PG 3 |
PSA: | 0.00000 |
LogP: | 2.72730 |
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The Benzene,2-bromo-1,3-difluoro-, with the CAS registry number 64248-56-2, is also known as 1-Bromo-2,6-difluorobenzene. It belongs to the product categories of Fluorobenzene; Aromatic Halides (substituted); Miscellaneous; Bromine Compounds; Fluorine Compounds; Aryl; C6; Halogenated Hydrocarbons. Its EINECS number is 264-750-2. This chemical's molecular formula is C6H3BrF2 and formula weight is 192.99. What's more, its IUPAC name is 2-bromo-1,3-difluorobenzene.
Physical properties of Benzene,2-bromo-1,3-difluoro- are: (1)ACD/LogP: 2.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.96; (4)ACD/BCF (pH 5.5): 104.07; (5)ACD/KOC (pH 5.5): 967.39 9; (6)Index of Refraction: 1.506; (7)Molar Refractivity: 33.93 cm3; (8)Molar Volume: 114 cm3; (9)Surface Tension: 32.3 dyne/cm; (10)Density: 1.692 g/cm3; (11)Flash Point: 53.3 °C; (12)Enthalpy of Vaporization: 37.08 kJ/mol; (13)Boiling Point: 149.8 °C at 760 mmHg; (14)Vapour Pressure: 5.04 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It is flammable and irritating to eyes, respiratory system and skin. In case of contact with eyes, you need rinse immediately with plenty of water and seek medical advice. When using it, you should wear suitable protective clothing, gloves and eye/face protection. You must keep this chemical away from sources of ignition - No smoking.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(F)c1Br
(2)InChI: InChI=1S/C6H3BrF2/c7-6-4(8)2-1-3-5(6)9/h1-3H
(3)InChIKey: HRZTZLCMURHWFY-UHFFFAOYSA-N