326720
六氟苯
≥99.5%, NMR grade
别名:
1,2,3,4,5,6--六氟苯, 全氟苯
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关于此项目
经验公式（希尔记法）:
C6F6
化学文摘社编号:
分子量:
186.05
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
206-876-2
Beilstein/REAXYS Number:
1683438
MDL number:
Assay:
≥99.5%
Form:
liquid
InChI key
ZQBFAOFFOQMSGJ-UHFFFAOYSA-N
InChI
1S/C6F6/c7-1-2(8)4(10)6(12)5(11)3(1)9
SMILES string
Fc1c(F)c(F)c(F)c(F)c1F
assay
≥99.5%
form
liquid
technique(s)
NMR: suitable
Quality Level
bp
80-82 °C (lit.)
mp
3.7-4.1 °C (lit.)
density
1.612 g/mL at 25 °C (lit.)
functional group
fluoro
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General description
六氟苯被报道为肿瘤氧合的一种灵敏的19F NMR指示剂。 使用单模氩激光作为激发源，在高分辨率下研究了六氟苯的旋转拉曼光谱。 气相中的六氟苯可自发地与锂汞齐发生反应，产生氟化锂和元素聚合碳及少量超化学计量锂的固体紧密混合物。 六氟苯与萘、蒽、菲、芘和三亚苯可形成一系列1:1的配合物。
Application
六氟苯可以用作19氟 NMR (核磁共振)波谱法的标准品，也可用作 13碳和 1H NMR 波谱法中的溶剂。
signalword
Danger
hcodes
Hazard Classifications
Flam. Liq. 2
存储类别
3 - Flammable liquids
wgk
WGK 3
flash_point_f
50.0 °F - closed cup
flash_point_c
10 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
Absolute temperature dependence of chemical shifts of lock solvents. Tetramethylsilane, hexafluorobenzene, and 1, 4-dibromotetrafluorobenzene
Jameson AK and Jameson CJ
Journal of the American Chemical Society, 95(26), 8559-8561 (1973)
Reactivity of M (en) Cl 2 (M= Pd II/Pt II, en= 1, 2-diaminoethane) with N, N′-bis (salicylidene)-p-phenylenediamine: binding with hexafluorobenzene
Kumari N, et al.
Polyhedron, 27(1), 241-248 (2008)
Solvent shift induced by hexafluorobenzene in NMR spectra
Nikki K and Nakagawa N
Chemistry Letters (Jpn), 3(7), 699-700 (1974)
Arene-perfluoroarene interactions in crystal engineering 8: structures of 1: 1 complexes of hexafluorobenzene with fused-ring polyaromatic hydrocarbons.
Collings JC, et al.
New. J. Chem., 26(12), 1740-1746 (2002)
M Albertí et al.
The journal of physical chemistry. A, 115(40), 10871-10879 (2011-09-03)
The effect of some leading intermolecular interaction components on specific features of weakly bound clusters involving an aromatic molecule, a closed shell ion, and Ar atoms is analyzed by performing molecular dynamics simulations on potential energy surfaces properly formulated in
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