Name | 4-Chloro-3-(trifluoromethyl)phenyl isocyanate |
Synonyms | 4-Chloro-α,α,α-trifluoro-m-tolyl isocyanate 3-TRIFLUOROMETHYL-4-CHLORO-PHENYL ISOCYANATE 4-Chloro-3-(trifluoromethyl)phenylisocyanate 4-Chloro-3-(trifluoromethyl)phenyl isocyanate 4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE 1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene Benzene, 1-chloro-4-isocyanato-2-(trifluoromethyl)- |
CAS | 327-78-6 |
EINECS | 000-000-0 |
InChI | InChI=1/C8H3ClF3NO/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h1-3H |
InChIKey | AHFPRSSHNSGRCU-UHFFFAOYSA-N |
Molecular Formula | C8H3ClF3NO |
Molar Mass | 221.56 |
Density | 1.4720 (estimate) |
Melting Point | 40-42°C(lit.) |
Boling Point | 86-90°C14mm Hg(lit.) |
Flash Point | 211°F |
Vapor Presure | 91Pa at 20℃ |
Appearance | Low Melting Solid, Powder or Chunks |
Color | White to yellow |
BRN | 522032 |
Storage Condition | under inert gas (nitrogen or Argon) at 2-8°C |
Sensitive | Moisture Sensitive |
Refractive Index | 1.487 |
MDL | MFCD00013874 |
Hazard Symbols | Xn - Harmful |
Risk Codes | R20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R36/37 - Irritating to eyes and respiratory system. R36/37/38 - Irritating to eyes, respiratory system and skin. R42 - May cause sensitization by inhalation R20/22 - Harmful by inhalation and if swallowed. |
Safety Description | S7 - Keep container tightly closed. S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S27 - Take off immediately all contaminated clothing. S37/39 - Wear suitable gloves and eye/face protection S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S23 - Do not breathe vapour. |
UN IDs | UN 2206 6.1/PG 3 |
WGK Germany | 3 |
HS Code | 29291090 |
Hazard Note | Harmful/Moisture Sensitive |
Hazard Class | 6.1 |
Packing Group | III |
use | 4-chloro-3-trifluoromethyl isocyanate phenyl ester is an important intermediate for the production of anti-tumor drug sorafenib. |
application | 4-chloro-3-trifluoromethyl isocyanate phenyl ester is an intermediate in organic synthesis and pharmaceutical research and development, which can be used as a laboratory organic synthesis process and pharmaceutical research and development process. |