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Merck
CN

O2706

Octafluorotoluene

98%

Synonym(s):

Perfluorotoluene

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About This Item

Linear Formula:
C6F5CF3
CAS Number:
Molecular Weight:
236.06
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
207-104-7
Beilstein/REAXYS Number:
2057072
MDL number:
Assay:
98%
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Quality Level

assay

98%

refractive index

n20/D 1.368 (lit.)

bp

104 °C (lit.)

density

1.666 g/mL at 25 °C (lit.)

SMILES string

Fc1c(F)c(F)c(c(F)c1F)C(F)(F)F

InChI

1S/C7F8/c8-2-1(7(13,14)15)3(9)5(11)6(12)4(2)10

InChI key

USPWUOFNOTUBAD-UHFFFAOYSA-N



pictograms

FlameSkull and crossbones

signalword

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

68.0 °F - closed cup

flash_point_c

20 °C - closed cup

ppe

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

Regulatory Information

危险化学品

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M H Baker et al.
Biomedical & environmental mass spectrometry, 16(1-12), 211-213 (1988-10-01)
The use of octafluorotoluene (OFT) as a versatile gas chromatographic/mass spectrometric derivatizing agent for steroids containing alcoholic, phenolic or alpha, beta-unsaturated keto functions, is described. Two distinct derivatizing schemes can be utilized, involving (method 1) a phase-transfer reaction, employing a
Alexander V Belyakov et al.
The journal of physical chemistry. A, 124(49), 10216-10224 (2020-11-18)
The equilibrium molecular structure of the gaseous fluorofullerene C60F36 has been determined for the first time by the electron diffraction method with the use of quantum chemical calculations up to the RI-MP2/def2-TZVPP level of theory. Vibrational amplitudes and quadratic and
Z Fang et al.
Anesthesia and analgesia, 83(5), 1097-1104 (1996-11-01)
We examined the anesthetic and convulsant properties of 16 unfluorinated to completely fluorinated aromatic compounds, having six to nine carbon atoms (e.g., benzene to 1,3,5-tris(trifluoromethyl)benzene), and four cycloalkanes (cyclopentane to cyclooctane). Benzene, fluorobenzene, toluene, p-xylene, ethylbenzene, and cyclopentane caused excitation



Global Trade Item Number

SKUGTIN
O2706-5G04061837594724