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alpha,alpha,alpha-Trifluoro-o-cresol Structure

alpha,alpha,alpha-Trifluoro-o-cresol

Chemical Properties

Melting point 45-46 °C (lit.)
Boiling point 147-148 °C (lit.)
Density  1.3
Flash point 150 °F
storage temp.  Inert atmosphere,2-8°C
form  Crystalline Low Melting Solid
pka 8.95(at 25℃)
color  White
BRN  1867917
Stability Stable. Flammable. Incompatible with oxidizing agents, acid chlorides, acid anhydrides.
InChI 1S/C7H5F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h1-4,11H
InChIKey ZOQOPXVJANRGJZ-UHFFFAOYSA-N
SMILES Oc1ccccc1C(F)(F)F
CAS DataBase Reference 444-30-4(CAS DataBase Reference)
NIST Chemistry Reference Phenol, 2-(trifluoromethyl)-(444-30-4)
EPA Substance Registry System 2-(Trifluoromethyl)phenol (444-30-4)

Safety Information

Hazard Codes  Xn,Xi
Risk Statements  20/21/22-36/37/38-41
Safety Statements  26-36-24/25
RIDADR  UN 1325 4.1/PG 2
WGK Germany  3
Hazard Note  Irritant
HazardClass  8
PackingGroup  Ⅱ
HS Code  29081990
Storage Class 4.1B - Flammable solid hazardous materials
Hazard Classifications Acute Tox. 4 Oral
Eye Dam. 1
Flam. Sol. 1
Skin Irrit. 2
STOT SE 3

MSDS

Usage And Synthesis

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