365866
4-Methylbenzotrifluoride
98%
Synonym(s):
α,α,α-Trifluoro-p-xylene
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About This Item
Linear Formula:
CH3C6H4CF3
CAS Number:
Molecular Weight:
160.14
UNSPSC Code:
12352100
PubChem Substance ID:
EC Number:
228-124-2
MDL number:
assay
98%
refractive index
n20/D 1.426 (lit.)
bp
129 °C (lit.)
density
1.144 g/mL at 25 °C (lit.)
SMILES string
Cc1ccc(cc1)C(F)(F)F
InChI
1S/C8H7F3/c1-6-2-4-7(5-3-6)8(9,10)11/h2-5H,1H3
InChI key
LRLRAYMYEXQKID-UHFFFAOYSA-N
General description
4-Methylbenzotrifluoride is a halogenated hydrocarbon.
Application
4-Methylbenzotrifluoride may be used in the preparation of 2-(4-methylphenyl) benzothiazole.
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
80.6 °F - closed cup
flash_point_c
27 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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2-Arylbenzothiazoles and 2-Arylbenzoxazoles from a, a, a-Trihalomethyl Aromatic Compounds.
So Y-H and Decaire R.
Synthetic Communications, 28(22), 4123-4135 (1998)
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