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612685

α,α,α-Trifluorotoluene solution

suitable for NMR (reference standard), 0.05% in benzene-d6 (99.6 atom % D), NMR tube size 3 mm × 8 in.

Synonym(s):

Benzotrifluoride

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About This Item

Linear Formula:
C6H5CF3
CAS Number:
98-08-8
Molecular Weight:
146.11
NACRES:
NA.12
PubChem Substance ID:
24882104
UNSPSC Code:
12142201
EC Number:
214-061-8
MDL number:
MFCD00000372

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InChI key

GETTZEONDQJALK-UHFFFAOYSA-N

InChI

1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H

SMILES string

FC(F)(F)c1ccccc1

concentration

0.05% in benzene-d6 (99.6 atom % D)

technique(s)

NMR: suitable

NMR tube size

3 mm × 8 in.

suitability

suitable for NMR (reference standard)

Quality Level

200

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1 of 4

This Item
733806T63703551406
α,α,α-Trifluorotoluene solution suitable for NMR (reference standard), 0.05% in benzene-d6 (99.6 atom % D), NMR tube size 3 mm × 8 in.

Sigma-Aldrich

612685

α,α,α-Trifluorotoluene solution

α,α,α-Trifluorotoluene solution suitable for NMR (reference standard), 0.05% in benzene-d6 (99.6 atom % D), NMR tube size 10 mm × 8 in.

Sigma-Aldrich

733806

α,α,α-Trifluorotoluene solution

α,α,α-Trifluorotoluene ≥99%

Sigma-Aldrich

T63703

α,α,α-Trifluorotoluene

α,α,α-Trifluorotoluene solution suitable for NMR (reference standard), 0.05% in benzene-d6 (99.6 atom % D)

Sigma-Aldrich

551406

α,α,α-Trifluorotoluene solution

grade

NMR reference standard

grade

NMR reference standard

grade

-

grade

NMR reference standard

technique(s)

NMR: suitable

technique(s)

NMR: suitable

technique(s)

-

technique(s)

NMR: suitable

Quality Level

200

Quality Level

200

Quality Level

200

Quality Level

200

concentration

0.05% in benzene-d6 (99.6 atom % D)

concentration

0.05% in benzene-d6 (99.6 atom % D)

concentration

-

concentration

0.05% in benzene-d6 (99.6 atom % D)

NMR tube size

3 mm × 8 in.

NMR tube size

10 mm × 8 in.

NMR tube size

-

NMR tube size

5 mm × 7 in. , 5 mm × 8 in.

Features and Benefits

19F sensitivity

Preparation Note

3 mm O.D. tube contains 0.235 mL.

signalword

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Carc. 1A - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 1B - Skin Irrit. 2 - STOT RE 1

target_organs

Blood

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

12.2 °F - closed cup

flash_point_c

-11 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
TV0211
ST0715
CR0407

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Oxidative trifluoromethylation of arylboronates with shelf-stable potassium (trifluoromethyl)trimethoxyborate.
Bilal A Khan et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 18(6), 1577-1581 (2012-01-13)
Studies on the mutagenic activity of benzotrifluoride and twelve derivatives in microbial short-term assays.
G Mazza et al.
Il Farmaco; edizione pratica, 41(7), 215-225 (1986-07-01)
Tao Tang et al.
Journal of chromatography. B, Analytical technologies in the biomedical and life sciences, 877(5-6), 507-512 (2009-01-24)
Eighteen samples of commercially available Chinese beer were analyzed in order to determine the content of biogenic amines. The method involves pre-column derivatization of the amines with 4-chloro-3,5-dinitrobenzotrifluoride (CNBF) and subsequent analysis by RP-HPLC (reversed phase-high performance liquid chromatography) with
R A Yadav et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 64(2), 454-463 (2006-01-18)
Force field calculations have been carried out for 2-amino-5-chloro- and 2-amino-5-bromo-benzotrifluorides using the earlier (Ref. of this article) reported IR and Raman spectra. As the frequencies of the corresponding modes for the C-Br and the C-Cl groups do not differ
C Yost et al.
Applied occupational and environmental hygiene, 15(1), 165-170 (2000-03-11)
Three solvents (OXSOL 10, monochlorotoluene or mixed isomers of 1- chloro-2-methyl benzene and 1-chloro-4-methyl benzene; OXSOL 100, parachlorobenzotrifluoride or 1-chloro-4-(trifluoromethyl) benzene; and OXSOL 2000, benzotrifluoride or trifluoromethyl benzene) produced by Occidental Chemical Corporation (Niagara Falls, NY) were considered as candidates
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