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158435-41-7

Basic Information
CAS No.: 158435-41-7
Name: 2-Chloro-4-bromobenzaldehyde
Article Data: 16
Molecular Structure:
Molecular Structure of 158435-41-7 (2-Chloro-4-bromobenzaldehyde)
Formula: C7H4BrClO
Molecular Weight: 219.465
Synonyms: 4-Bromo-2-chlorobenzaldehyde;
Density: 1.698 g/cm3
Melting Point: 74-76℃
Boiling Point: 271.3 °C at 760 mmHg
Flash Point: 117.9 °C
Hazard Symbols: CorrosiveC
Risk Codes:  C:Corrosive;
">  C:Corrosive;
PSA: 17.07000
LogP: 2.91500
Synthetic route
960053-48-9

4-bromo-2-chloro-1-(dibromomethyl)benzene

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
With silver nitrate In ethanol; water for 1.33333h; Reflux;99%
With silver nitrate In water for 1h; Heating / reflux;97%
185315-48-4

(4-bromo-2-chlorophenyl)methanol

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Stage #1: (4-bromo-2-chlorophenyl)methanol With oxalyl dichloride; dimethyl sulfoxide In dichloromethane at -78℃; for 2h; Swern Oxidation;
Stage #2: With triethylamine In dichloromethane at 20℃; for 0.5h;
96%
95%
With dipyridinium dichromate In dichloromethane Inert atmosphere;88%
31928-47-9

4-bromo-2-chloroiodobenzene

68-12-2, 33513-42-7

N,N-dimethyl-formamide

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Stage #1: 4-bromo-2-chloroiodobenzene With isopropylmagnesium chloride In tetrahydrofuran at -70 - -60℃; for 0.166667h;
Stage #2: N,N-dimethyl-formamide In tetrahydrofuran at -60 - 20℃; for 1h;
67%
89-98-5

2-chloro-benzaldehyde

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
With sulfuric acid; C18H16Br4N2O3V; dihydrogen peroxide; potassium bromide In methanol; water at 20℃; for 2h; Catalytic behavior;43.5%
With sulfuric acid; C20H22Br2N2O5V; dihydrogen peroxide In methanol; water at 20℃; for 1.08333h; Catalytic behavior;41%
154607-01-9

4-bromo-2-chlorobenzonitrile

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Stage #1: 4-bromo-2-chlorobenzonitrile With diisobutylaluminium hydride In dichloromethane; toluene at -60 - 20℃; for 3.5h;
Stage #2: With hydrogenchloride In dichloromethane; water; ethyl acetate; toluene at 0 - 20℃;
Stage #1: 4-bromo-2-chlorobenzonitrile With diisobutylaluminium hydride In toluene at -78 - -50℃; for 4h;
Stage #2: With water In methanol; toluene at -50℃; for 0.166667h;
59748-90-2

4-Bromo-2-chloro-benzoic Acid

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: borane-THF / tetrahydrofuran / 0 - 40 °C
2: pyridinium chlorochromate / dichloromethane / 3 h / 25 °C
View Scheme
Multi-step reaction with 2 steps
1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol; triethylamine / N,N-dimethyl-formamide / 17 h / 20 °C
2: lithium aluminium tetrahydride / tetrahydrofuran / 1 h / Cooling with ice
View Scheme
Multi-step reaction with 3 steps
1: hydrogenchloride / 12 h / Reflux; Inert atmosphere
2: lithium borohydride / tetrahydrofuran; methanol / 0 - 22 °C / Inert atmosphere
3: dipyridinium dichromate / dichloromethane / Inert atmosphere
View Scheme
Multi-step reaction with 2 steps
1: borane-THF / tetrahydrofuran / 4.33 h / 0 - 20 °C
2: dipyridinium dichromate / dichloromethane / 1 h / 20 °C
View Scheme
25118-59-6

4-bromo-3-chlorobenzoic acid

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: diborane / tetrahydrofuran / 0 - 40 °C
2: pyridinium chlorochromate / dichloromethane / 3 h / 25 °C
View Scheme
875306-64-2

4-bromo-2-chloro-N-methoxy-N-methylbenzamide

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
With lithium aluminium tetrahydride In tetrahydrofuran for 1h; Cooling with ice;4.05 g
1122-91-4

4-bromo-benzaldehyde

A

111829-72-2

4-bromo-2,6-dichlorobenzaldehyde

B

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
With N-chloro-succinimide; palladium diacetate; silver trifluoroacetate; anthranilic acid; trifluoroacetic acid In 1,2-dichloro-ethane at 60℃; for 24h; Sealed tube; Overall yield = 72 %; Overall yield = 47 mg;
185312-82-7

4-bromo-2-chlorobenzoic acid methyl ester

158435-41-7

4-bromo-2-chlorobenzaldehyde

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: lithium borohydride / tetrahydrofuran; methanol / 0 - 22 °C / Inert atmosphere
2: dipyridinium dichromate / dichloromethane / Inert atmosphere
View Scheme
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Chemistry

Molecular Structure of 2-Chloro-4-bromobenzaldehyde (CAS No.158435-41-7):
 
Molecular Formula: C7H4BrClO 
Molecular Weight: 219.4631
CAS No: 158435-41-7
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 17.07 Å2
Index of Refraction: 1.623
Molar Refractivity: 45.59 cm3
Molar Volume: 129.2 cm3
Surface Tension: 47.1 dyne/cm
Density: 1.698 g/cm3
Flash Point: 117.9 °C
Enthalpy of Vaporization: 50.95 kJ/mol
Boiling Point: 271.3 °C at 760 mmHg
Vapour Pressure: 0.0065 mmHg at 25°C
InChI: InChI=1/C7H4BrClO/c8-6-2-1-5(4-10)7(9)3-6/h1-4H
InChIKey: DHGPLNJITGVCSG-UHFFFAOYAB
Std. InChI: InChI=1S/C7H4BrClO/c8-6-2-1-5(4-10)7(9)3-6/h1-4H
Std. InChIKey: DHGPLNJITGVCSG-UHFFFAOYSA-N
Product Categories: Adehydes, Acetals Ketones;Bromine Compounds;Chlorine Compounds

Safety Profile

Hazard Codes: CorrosiveC
Hazard Note: Corrosive

Specification

   2-Chloro-4-bromobenzaldehyde (CAS No.158435-41-7), its synonyms are 4-Bromo-2-chlorobenzaldehyde ; Benzaldehyde, 4-bromo-2-chloro- ; 2-Chloro-4-bromobenzaldehyde .