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CAS No.: | 1073-06-9 |
---|---|
Name: | 3-Bromofluorobenzene |
Article Data: | 23 |
Molecular Structure: | |
Formula: | C6H4BrF |
Molecular Weight: | 175 |
Synonyms: | 1-Bromo-3-fluorobenzene;1-Fluoro-3-bromobenzene;3-Bromo-1-fluorobenzene;3-Fluoro-1-bromobenzene;3-Fluorobromobenzene;3-Fluorophenyl bromide;NSC10267;m-Bromofluorobenzene;m-Fluorobromobenzene; |
EINECS: | 214-023-0 |
Density: | 1.593 g/cm3 |
Melting Point: | -8 °C |
Boiling Point: | 150 °C at 760 mmHg |
Flash Point: | 38.9 °C |
Solubility: | insoluble in water |
Appearance: | clear colourless tolight yellow liquid |
Hazard Symbols: | Xi |
Risk Codes: | 10-22-36/38-36/37/38-20/21/22 |
Safety: | 26-36-37/39-16 |
Transport Information: | UN 1993 3/PG 3 |
PSA: | 0.00000 |
LogP: | 2.58820 |
(3-fluorophenyl)(mesityl)iodonium trifluoromethanesulfonate
3-fluorobromobenzene
Conditions | Yield |
---|---|
With copper(I) bromide In acetonitrile at 80℃; for 2h; | 91% |
3-fluorobromobenzene
Conditions | Yield |
---|---|
With copper(I) oxide; sulfuric acid; sodium nitrite In water; isopropyl alcohol at -10 - 0℃; for 5h; Temperature; Reagent/catalyst; Solvent; | 82.7% |
1,1,1-trifluoro-4-methyl-pent-3-en-2-one
A
2,2′-dibromo-4,4′-difluorobiphenyl
B
3-fluorobromobenzene
C
4-(2-bromo-4-fluorophenyl)-1,1,1-trifluoro-4-methylpentan-2-one
D
2-(2-bromo-4-fluorophenyl)-1,1,1-trifluoro-4-methylpent-3-en-2-ol
E
2-bromo-4-fluoro-phenol
Conditions | Yield |
---|---|
Stage #1: 2-bromo-4-fluoro-1-iodobenzene With isopropylmagnesium chloride In tetrahydrofuran at -30 - -25℃; for 0.5h; Inert atmosphere; Large scale; Stage #2: 1,1,1-trifluoro-4-methyl-pent-3-en-2-one With copper(l) iodide In tetrahydrofuran at -30 - -25℃; for 4h; Inert atmosphere; Large scale; | A 0.5% B 16% C 75% D 5% E 0.5% |
bromobenzene
A
o-fluorobromobenzene
B
3-fluorobromobenzene
C
1-Bromo-4-fluorobenzene
Conditions | Yield |
---|---|
With fluorine In trichlorofluoromethane at -78℃; for 1h; | A 23 % Chromat. B 17 % Chromat. C 60 % Chromat. |
With fluorine In trichlorofluoromethane at -78℃; for 1h; Rate constant; Product distribution; competitive reaction with benzene; | A 23 % Chromat. B 17 % Chromat. C 60 % Chromat. |
With xenon difluoride; boron trifluoride diethyl etherate In acetonitrile at -35 - 20℃; for 2.5h; Inert atmosphere; Overall yield = 56 %; |
Conditions | Yield |
---|---|
With bromobenzene; Cu-HZSM-5 zeolite at 399.9℃; Mechanism; various catalysts; | 14.3 % Chromat. |
carbon disulfide
fluorobenzene
bromine
A
o-fluorobromobenzene
B
3-fluorobromobenzene
C
1-Bromo-4-fluorobenzene
Conditions | Yield |
---|---|
at 55℃; Product distribution; |
tetrachloromethane
fluorobenzene
A
o-fluorobromobenzene
B
3-fluorobromobenzene
C
4-fluoro-1-iodobenzene
D
1-Bromo-4-fluorobenzene
Conditions | Yield |
---|---|
Product distribution; |
fluorobenzene
A
o-fluorobromobenzene
B
3-fluorobromobenzene
C
1-Bromo-4-fluorobenzene
Conditions | Yield |
---|---|
With bromine at 25℃; for 16h; Irradiation; Yield given; |
3-fluorobromobenzene
Conditions | Yield |
---|---|
With bromine at 400 - 700℃; |
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IUPAC Name: 1-bromo-3-fluorobenzene
Empirical Formula: C6H4BrF
Molecular Weight: 174.9984g/mol
EINECS: 214-023-0
Structure of Benzene,1-bromo-3-fluoro- (CAS NO.1073-06-9):
Index of Refraction: 1.53
Molar Refractivity: 33.93 cm3
Molar Volume: 109.8 cm3
Polarizability: 13.45×10-24cm3
Surface Tension: 33.8 dyne/cm
Density: 1.593 g/cm3
Flash Point: 38.9 °C
Enthalpy of Vaporization: 37.09 kJ/mol
Melting Point: -8°C
Boiling Point: 150 °C at 760 mmHg
Vapour Pressure: 4.99 mmHg at 25°C
storage temp: Flammables area
Water Solubility: insoluble
Product Categories: Aromatic Hydrocarbons (substituted) & Derivatives;Benzene series;Fluorobenzene;Bromine Compounds;Fluorine Compounds;Fluorobenzene Series;Aryl;C6;Halogenated Hydrocarbons
Canonical SMILES: C1=CC(=CC(=C1)Br)F
InChI: InChI=1S/C6H4BrF/c7-5-2-1-3-6(8)4-5/h1-4H
InChIKey: QDFKKJYEIFBEFC-UHFFFAOYSA-N
Intermediates of Liquid Crystals.
1. | skn-rbt 500 mg/24H MOD | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,32. | ||
2. | eye-rbt 20 mg/24H MOD | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,32. |
Reported in EPA TSCA Inventory.
A skin and eye irritant. When heated to decomposition it emits very toxic fumes of F− and Br−.
The Hazard Codes of Benzene,1-bromo-3-fluoro- (1073-06-9): Xn,Xi, F
Hazard Note: Flammable/Irritant
HazardClass: 3
The Risk Statements information of Benzene,1-bromo-3-fluoro- (1073-06-9):
10: Flammable
22: Harmful if swallowed
20/21/22: Harmful by inhalation, in contact with skin and if swallowed
36/37/38: Irritating to eyes, respiratory system and skin
36/38: Irritating to eyes and skin
The Safety Statements information of Benzene,1-bromo-3-fluoro- (1073-06-9):
16: Keep away from sources of ignition - No smoking
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37/39: Wear suitable gloves and eye/face protection
RIDADR: UN 1993 3/PG 3
WGK Germany: 2
RTECS: DA1225000
PackingGroup: III
HS Code: 29036990
Benzene,1-bromo-3-fluoro- , its cas register number is 1073-06-9. It also can be called 1-Bromo-3-fluorobenzene ; 1-Fluoro-3-bromobenzene ; 3-Bromfluorbenzen ; 3-Bromofluorobenzene ; m-Bromofluorobenzene ; m-Fluorobromobenzene ;
m-Fluorophenyl bromide . Benzene,1-bromo-3-fluoro- (CAS NO.1073-06-9) is a clear colourless tolight yellow liquid.