| Identification | More | [Name]
4-Chloro-3-(trifluoromethyl)phenyl isocyanate | [CAS]
327-78-6 | [Synonyms]
4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE
3-TRIFLUOROMETHYL-4-CHLORO-PHENYL ISOCYANATE
4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL ISOCYANATE 98%
1-Chloro-4-isocyanato-2-(trifluoromethyl)benzene
4-Chloro-α,α,α-trifluoro-m-tolyl isocyanate | [EINECS(EC#)]
-0 | [Molecular Formula]
C8H3ClF3NO | [MDL Number]
MFCD00013874 | [Molecular Weight]
221.56 | [MOL File]
327-78-6.mol |
| Chemical Properties | Back Directory | [Appearance]
White solid or melt | [Melting point ]
40-42 °C(lit.)
| [Boiling point ]
86-90 °C14 mm Hg(lit.)
| [density ]
1.4720 (estimate) | [vapor pressure ]
91Pa at 20℃ | [Fp ]
211 °F
| [storage temp. ]
Inert atmosphere,2-8°C | [solubility ]
soluble in Chloroform, Methanol | [form ]
Low Melting Solid, Powder or Chunks | [color ]
White to yellow | [Sensitive ]
Moisture Sensitive | [BRN ]
522032 | [InChI]
InChI=1S/C8H3ClF3NO/c9-7-2-1-5(13-4-14)3-6(7)8(10,11)12/h1-3H | [InChIKey]
AHFPRSSHNSGRCU-UHFFFAOYSA-N | [SMILES]
C1(Cl)=CC=C(N=C=O)C=C1C(F)(F)F | [CAS DataBase Reference]
327-78-6(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
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 Statements ]
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 label where possible) .
S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) . | [RIDADR ]
UN 2206 6.1/PG 3
| [WGK Germany ]
3
| [Hazard Note ]
Harmful/Moisture Sensitive | [HazardClass ]
6.1 | [PackingGroup ]
III | [HS Code ]
29291090 |
| Hazard Information | Back Directory | [Chemical Properties]
White solid or melt | [Uses]
4-Chloro-3-(trifluoromethyl)phenyl isocyanate may be used in the synthesis of:
N-(5′-deoxy-3′-O-tert-butyldimethylsilyl-β-D-thymidin-5′-yl)-N′-(4-chloro-3-trifluoromethylphenyl)-thiourea
[1,3-bis(4-chloro-α,α,α-trifluoro-m-tolyl)urea]
trans-1-(4-chloro-3-trifluoromethyl-phenyl)-3-(4-hydroxy-cyclohexyl)-urea | [General Description]
4-Chloro-3-(trifluoromethyl)phenyl isocyanate participates in an efficient methodology for the synthesis of 5-methyl-3-aryl-2-thiooxazolidin-4-ones. | [Flammability and Explosibility]
Nonflammable |
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