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Merck
CN

406228

3-(Trifluoromethyl)pyrazole

99%

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About This Item

Empirical Formula (Hill Notation):
C4H3F3N2
CAS Number:
Molecular Weight:
136.08
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
1564179
Assay:
99%
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assay

99%

bp

70 °C/2 mmHg (lit.)

mp

45-47 °C (lit.)

SMILES string

FC(F)(F)c1cc[nH]n1

InChI

1S/C4H3F3N2/c5-4(6,7)3-1-2-8-9-3/h1-2H,(H,8,9)

InChI key

PYXNITNKYBLBMW-UHFFFAOYSA-N

General description

3-(Trifluoromethyl)pyrazoles is a heterocyclic building block. It undergoes alkylation with alkyl iodides in DMF to afford the N-alkyl pyrazoles. It participates in the synthesis of disubstituted pyrimidines.

Application

3-(Trifluoromethyl)pyrazole may be used in copper-catalyzed pyrazole N-arylation. It may be used in the synthesis of sodium hydridotris(1H-3-trifluoromethylpyrazol-1-yl)borate by heating with sodium borohydride.


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves



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