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Merck
CN

224936

4-(Trifluoromethyl)aniline

99%

Synonym(s):

α,α,α-Trifluoro-p-toluidine, 4-Aminobenzotrifluoride

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About This Item

Linear Formula:
CF3C6H4NH2
CAS Number:
Molecular Weight:
161.12
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
207-236-5
Beilstein/REAXYS Number:
1564853
MDL number:
Assay:
99%
Form:
liquid
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Quality Level

assay

99%

form

liquid

refractive index

n20/D 1.483 (lit.)

bp

83 °C/12 mmHg (lit.)

density

1.283 g/mL at 25 °C (lit.)

storage temp.

2-8°C

SMILES string

Nc1ccc(cc1)C(F)(F)F

InChI

1S/C7H6F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H,11H2

InChI key

ODGIMMLDVSWADK-UHFFFAOYSA-N

Application

4-(Trifluoromethyl)aniline was used in the synthesis of 4-(trialkylmethyl)anilines. It was also used as a synthetic building block.


signalword

Danger

Hazard Classifications

Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

wgk

WGK 3

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter



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A Facile Synthesis of 4-(Trialkylmethyl) anilines by the Reaction of 4-(Trifluoromethyl) aniline with Grignard Reagents.
Synthetic Communications, 27(11), 1975-1980 (1997)
Tetrahedron Letters, 48, 4749-4749 (2007)
Meritxell Guinó et al.
The Journal of organic chemistry, 72(16), 6290-6293 (2007-07-13)
Optically active torcetrapib was synthesized in seven steps from achiral precursors without the need for protecting groups, utilizing an enantioselective aza-Michael reaction to achieve asymmetry.



Global Trade Item Number

SKUGTIN
224936-10G04061838779311
224936-25G04061838779335
224936-1G04061838779328