Trifluoro-p-tolunitrile
Synonym(s):α,α,α-Trifluoro-p-tolunitrile
- CAS NO.:455-18-5
- Empirical Formula: C8H4F3N
- Molecular Weight: 171.12
- MDL number: MFCD00001826
- EINECS: 207-239-1
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-08-17 21:30:02
What is Trifluoro-p-tolunitrile?
Chemical properties
white to light yellow crystal powder
The Uses of Trifluoro-p-tolunitrile
4-(Trifluoromethyl)benzonitrile is used in the synthesis of quinazolines for amidines. Also used in the synthesis of s-transferase p1-1 and cancer cell proliferation.
What are the applications of Application
4-(Trifluoromethyl)benzonitrile is a key intermediate in the synthesis of fluvoxamine
General Description
4-(Trifluoromethyl)benzonitrile is a key intermediate in the synthesis of fluvoxamine. It participates in nickel-catalyzed arylcyanation reaction of 4-octyne.
Properties of Trifluoro-p-tolunitrile
Melting point: | 39-41 °C(lit.) |
Boiling point: | 80-81 °C20 mm Hg(lit.) |
Density | 1.278 g/mL at 25 °C(lit.) |
refractive index | n |
Flash point: | 161 °F |
storage temp. | Sealed in dry,Room Temperature |
Water Solubility | Insoluble in water |
solubility | soluble in Chloroform, Methanol |
form | powder to lump to clear liquid |
color | White or Colorless to Light yellow |
Specific Gravity | 1.278 |
Sensitive | Lachrymatory |
BRN | 2046478 |
CAS DataBase Reference | 455-18-5(CAS DataBase Reference) |
NIST Chemistry Reference | 4-Trifluoromethylbenzoic acid nitrile(455-18-5) |
EPA Substance Registry System | Benzonitrile, 4-(trifluoromethyl)- (455-18-5) |
Safety information for Trifluoro-p-tolunitrile
Signal word | Danger |
Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H228:Flammable solids |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P240:Ground/bond container and receiving equipment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. |
Computed Descriptors for Trifluoro-p-tolunitrile
InChIKey | DRNJIKRLQJRKMM-UHFFFAOYSA-N |
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product: 455-18-5 4-(Trifluoromethyl)benzonitrile 98%
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