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| CAS No.: | 877-03-2 |
|---|---|
| Name: | 5-Bromoindole-3-carboxaldehyde |
| Molecular Structure: | |
|
|
|
| Formula: | C9H6BrNO |
| Molecular Weight: | 224.057 |
| Synonyms: | Indole-3-carboxaldehyde,5-bromo- (6CI,7CI,8CI);5-Bromo-1H-indole-3-carboxaldehyde;5-Bromo-3-formylindole;5-Bromoindole-3-carbaldehyde;NSC 66831; |
| EINECS: | 212-884-7 |
| Density: | 1.727 g/cm3 |
| Melting Point: | 204-207 °C(lit.) |
| Boiling Point: | 395.6 °C at 760 mmHg |
| Flash Point: | 193 °C |
| Solubility: | Insoluble in water,Soluble in ethanol, acetone |
| Appearance: | Beige to light brown crystalline powder |
| Hazard Symbols: |
 Xi, Xn
|
| Risk Codes: | 36/37/38-20/21/22 |
| Safety: | 26-36-37/39 |
| PSA: | 32.86000 |
| LogP: | 2.74290 |
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Chemistry
MF: C9H6BrNO
MW: 224.05
MS:.gif)
EINECS: 212-884-7
Melting Point: 204-206
Surface Tension: 63.5 dyne/cm
Density: 1.727 g/cm3
Flash Point: 193 °C
Enthalpy of Vaporization: 64.57 kJ/mol
Boiling Point: 395.6 °C at 760 mmHg
Vapour Pressure: 1.82E-06 mmHg at 25°C
Mol File: 877-03-2.mol
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 22 ?2
Index of Refraction: 1.752
Molar Refractivity: 52.97 cm3
Molar Volume: 129.7 cm3
Polarizability: 20.99 10-24cm3
Uses
1.5-Bromoindole-3-carboxaldehyde (CAS: 877-03-2 ) is an important intermediate in organic synthesis.
2.5-Bromoindole-3-carboxaldehyde (CAS: 877-03-2 ) is mainly used in pharmaceutical intermediates, organic synthesis, organic solvents.
3.It can also be used in dye production, pesticide production,spices and so on.
Safety Profile
Hazard Codes : Xi,Xn .gif)
Risk Statements : 36/37/38-20/21/22
36/37/38: Irritating to eyes, respiratory system and skin
20/21/22: Harmful by inhalation, in contact with skin and if swallowed
Safety Statements: 26-36-37/39
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
Personal Protective: Equipment dust mask type N95 (US), Eyeshields, Gloves
WGK Germany: 3
Specification
Product Name: 5-Bromoindole-3-carboxaldehyde (CAS: 877-03-2 )
Synonyms: Timtec-bb sbb010081 ; 5-Bromoindole-3-aldehyde ; 5-Bromoindole-3-carboxaldehyde ; 5-Bromoindole-3-carboxyaldehyde ; 5-Bromo-1h-indole-3-Carbaldehyde ; 5-Bromo-1h-indole-3-carboxaldehyde ; 5-Bromo-3-formylindole ; 5-Bromoindole-3-carbaldehyde
Appearance (Color): White to Light Yellow
Appearance (Form) :Powder
Infrared spectrum: Conforms to Structure
Purity (GC): ≥97.5 %
Titration by AgNO3: ≥97.5 % after Oxygen Combustion