Molecular Formula | C7H8BrN |
Molar Mass | 186.05 |
Density | 1.4700 (rough estimate) |
Melting Point | 57-59°C(lit.) |
Boling Point | 240°C(lit.) |
Flash Point | >230°F |
Vapor Presure | 0.0337mmHg at 25°C |
Appearance | White to bright yellow crystals |
BRN | 636521 |
pKa | 3.75±0.10(Predicted) |
Storage Condition | Keep in dark place,Sealed in dry,Room Temperature |
Refractive Index | 1.6190 (estimate) |
MDL | MFCD00007825 |
Physical and Chemical Properties | Pale yellow crystal |
Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37/38 - Irritating to eyes, respiratory system and skin. R33 - Danger of cumulative effects |
Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S37/39 - Wear suitable gloves and eye/face protection S24/25 - Avoid contact with skin and eyes. |
UN IDs | UN2811 |
WGK Germany | 3 |
RTECS | XU4250000 |
TSCA | Yes |
HS Code | 29214200 |
Hazard Note | Harmful |
Hazard Class | 6.1 |
Packing Group | III |
chemical properties | light yellow crystals |
production method | add 0.54g(5mmol) o-toluidine, 1.51g(5mmol)5,5-dibromomalonic acid isopropyl ester, 20mL anhydrous ether and 0.59(5mmol) triethylamine into a 50mL round bottom bottle, stir and react at room temperature for 5h, then add 15mL dichloromethane, wash with 10mL × 3 of 10% sodium bicarbonate solution and 20mL × 2 of water in turn, dry and distilled with anhydrous magnesium sulfate, after the solvent is recovered, the fraction at 238~240 ℃ is collected to obtain 0.59g of product with 93% yield. |
NIST chemical information | The information is: webbook.nist.gov provides (external link) |
EPA chemical information | The information is: offered by ofmpub.epa.gov (external link) |