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51417-51-7

Basic Information
CAS No.: 51417-51-7
Name: 7-Bromoindole
Article Data: 41
Cas Database
Molecular Structure:
Molecular Structure of 51417-51-7 (7-Bromoindole)
Formula: C8H6BrN
Molecular Weight: 196.046
Synonyms: 7-bromo indole;7-bromo-1H-indole;7-Bromoindole,7-Bromo-1H-indole;1H-Indole, 7-bromo;7-Bromo-indole;
EINECS: N/A
Density: 1.66 g/cm3
Melting Point: 41-44 °C(lit.)
Boiling Point: 316.9 °C at 760 mmHg
Flash Point: 145.5 °C
Solubility: N/A
Appearance: Beige-yellowish or brownish crystalline powder
Hazard Symbols: IrritantXi,HarmfulXn
Risk Codes: 36/37/38-20/21/22
Safety: 26-36-36/37/39-22-37/39
Transport Information: N/A
PSA: 15.79000
LogP: 2.93040
Synthetic route
189266-03-3

7-bromo-N-(4-toluenesulfonyl)-1H-indole

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With formic acid; (4,4'-di-tert-butyl-2,2'-dipyridyl)-bis-(2-phenylpyridine(-1H))-iridium(III) hexafluorophosphate; N-ethyl-N,N-diisopropylamine In acetonitrile at 20℃; for 24h; Inert atmosphere; Sealed tube; Irradiation;87%
74798-64-4

1-(2-amino-3-bromophenyl)-2-chloroethan-1-one

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With sodium tetrahydroborate In 1,4-dioxane; water for 1h; Heating;84%

7-bromo-1-(pyrimidin-2-yl)-1H-indole

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With sodium ethanolate In ethanol; dimethyl sulfoxide at 90℃; for 5h; Sealed tube; Inert atmosphere;79%
187099-50-9

(2-Bromo-6-trimethylsilanylethynyl-phenyl)-carbamic acid tert-butyl ester

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With sodium ethanolate In ethanol for 2h; Heating;77%
20780-74-9

7-bromoisatin

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With potassium borohydride; dimethyl sulfate In toluene at -10 - -5℃; Inert atmosphere;74%
With borane-THF In tetrahydrofuran at 0 - 20℃; for 48h;32%
62813-85-8

7-bromo-2,3-dihydroindole

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With salcomine; oxygen In methanol at 20℃; for 3h;73%
With salcomine In methanol for 11h; Ambient temperature;72%
With oxygen In N,N-dimethyl acetamide at 20℃; Schlenk technique; Irradiation;41%
577-19-5

2-nitrophenyl bromide

1826-67-1

vinyl magnesium bromide

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
In tetrahydrofuran at -45 - -40℃; for 25h;72%
In tetrahydrofuran at -45℃; for 0.583333h;72%
Stage #1: 2-nitrophenyl bromide; vinyl magnesium bromide In tetrahydrofuran at -40 - 0℃; for 2.5h; Inert atmosphere;
Stage #2: With hydrogenchloride; pivalaldehyde In tetrahydrofuran; water at 0℃; for 72h; Inert atmosphere;
70%
75816-19-2

(S)-7-bromo-tryptophan

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
With dipotassium hydrogenphosphate; tryptophanase TnaA at 25℃; pH=7.4; Enzymatic reaction;63.2%
577-19-5

2-nitrophenyl bromide

1826-67-1

vinyl magnesium bromide

A

59-48-3

2-oxoindole

B

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
In tetrahydrofuran at -40℃;A 30%
B 62%
577-19-5

2-nitrophenyl bromide

3536-96-7

vinylmagnesium chloride

51417-51-7

7-bromo-1H-indole

Conditions
ConditionsYield
In tetrahydrofuran at -70℃; for 3h; Cycloaddition;53%
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    Product Name: 7-Bromoindole Synonyms: 7-BROMO-1H-INDOLE;7-BROMOINDOLE;RARECHEM AH BS 0083;7-Bromoindole,97%;3-CYANO-7-CHLORO INDOLE;7-Bromoindole98%;7-BROMOCHROMANONE;7-broMo-4H-indole CAS: 51417-51-7

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Chemistry

IUPAC Name: 7-Bromo-1H-indole
Synonyms of 7-Bromoindole (CAS NO.51417-51-7): 7-Bromo-1h-indole ; Rarechem ah bs 0083 ; 7-Bromoindole98% ; 7-Bromoindole,97% ; 3-Cyano-7-chloro indole ; 7-Bromochromanone
CAS NO: 51417-51-7
Molecular Formula of 7-Bromoindole (CAS NO.51417-51-7): C8H6BrN
Molecular Weight: 196.0439
Molecular Structure:

Melting Point: 41-44 °C
ProductCategories: blocks;Bromides;IndolesOxindoles ; indole derivative ; Indoles and derivatives ; Halides ; Pyrroles & Indoles ; Indole ; Indoles ; Organohalides ; Simple Indoles ; Pyrroles & Indoles ; Halogenated Heterocycles ; Heterocyclic Building Blocks ; IndolesBuilding Blocks 
Polar Surface Area: 4.93 Å2
Index of Refraction: 1.711
Molar Refractivity: 46.21 cm3
Molar Volume: 118 cm3
Surface Tension: 54.8 dyne/cm
Density of 7-Bromoindole (CAS NO.51417-51-7): 1.66 g/cm3
Flash Point: 145.5 °C
Enthalpy of Vaporization: 53.61 kJ/mol
Boiling Point: 316.9 °C at 760 mmHg
Vapour Pressure: 0.000738 mmHg at 25°C

Safety Profile

Hazard Codes: IrritantXi,Xn
Risk Statements: 36/37/38-20/21/22 
R36/37/38: Irritating to eyes, respiratory system and skin. 
R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 26-36/37/39-22 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. 
S22: Do not breathe dust.
WGK Germany: 3
HazardClass: IRRITANT