Name | 5-Bromophthalide |
Synonyms | 5-Bromophthalide 5-BROMOPHTHALIDE 2,2-Dithiobenzoic acid 5-Bromo-1-isobenzofuranone 5-BROMO-3H-ISOBENZOFURANONE 5-BROMO-2-BENZOFURAN-(3H)-ONE 5-bromoisobenzofuran-1(3H)-one 5-bromo-3H-isobenzofuran-1-one 5-BROMO-1(3H)-ISOBENZOFURANONE 5-bromo-2-benzofuran-1(3H)-one |
CAS | 64169-34-2 |
EINECS | 613-485-4 |
InChI | InChI=1/C8H5BrO2/c9-6-1-2-7-5(3-6)4-11-8(7)10/h1-3H,4H2 |
InChIKey | IUSPXLCLQIZFHL-UHFFFAOYSA-N |
Molecular Formula | C8H5BrO2 |
Molar Mass | 213.03 |
Density | 1.742±0.06 g/cm3(Predicted) |
Melting Point | 162-166°C(lit.) |
Boling Point | 377.7±42.0 °C(Predicted) |
Flash Point | 182.2°C |
Solubility | Soluble in acetone. |
Vapor Presure | 6.63E-06mmHg at 25°C |
Appearance | Solid |
Color | Beige to light yellow |
Storage Condition | Inert atmosphere,Room Temperature |
Refractive Index | 1.625 |
MDL | MFCD01797360 |
Use | Used as a drug citalopram Intermediate |
Hazard Symbols | Xi - Irritant |
Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S37/39 - Wear suitable gloves and eye/face protection S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. |
WGK Germany | 2 |
RTECS | EJ9940000 |
HS Code | 29329990 |
Introduction | 5-bromo phthalide is an important intermediate of fine chemical industry, which is widely used in printing and dyeing, pesticide, pharmaceutical production and other chemical fields, is an important intermediate for the synthesis of antidepressant citalopram. |
Use | 5-bromo phthalide is a useful synthetic intermediate. It is used as a reactant in the synthesis of chiral 2-carboxy cyclic ethers. used as an intermediate of citalopram |