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877-03-2

Basic Information
CAS No.: 877-03-2
Name: 5-Bromoindole-3-carboxaldehyde
Article Data: 90
Molecular Structure:
Molecular Structure of 877-03-2 (5-Bromoindole-3-carboxaldehyde)
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: IrritantXi,HarmfulXn
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:
EINECS: 212-884-7
Melting Point: 204-206
Surface Tension: 63.5 dyne/cm
Density: 1.727 g/cm
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
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