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382957

2,6-Difluoronitrobenzene

98%

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About This Item

Linear Formula:
F2C6H3NO2
CAS Number:
19064-24-5
Molecular Weight:
159.09
NACRES:
NA.22
PubChem Substance ID:
24863927
UNSPSC Code:
12352100
EC Number:
242-793-8
MDL number:
MFCD00192035
Assay:
98%
Form:
solid
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Quality Segment

200

assay

98%

form

solid

refractive index

n20/D 1.494 (lit.)

bp

91-92 °C/11 mmHg (lit.)

density

1.503 g/mL at 25 °C (lit.)

functional group

fluoro, nitro

SMILES string

[O-][N+](=O)c1c(F)cccc1F

InChI

1S/C6H3F2NO2/c7-4-2-1-3-5(8)6(4)9(10)11/h1-3H

InChI key

SSNCMIDZGFCTST-UHFFFAOYSA-N

General description

2,6-Difluoronitrobenzene is an organic building block. Molecular structure, conformation and potential to internal rotation of 2,6-difluoronitrobenzene been studied by gas-phase electron diffraction (GED), MP2 ab initio, and by B3LYP density functional calculations.

Application

2,6-Difluoronitrobenzene may be used in the preparation of secondary amine precursors, required for the synthesis of two families of nitric oxide donors.

pictograms

Exclamation mark
GHS07

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

190.4 °F - closed cup

flash_point_c

88 °C - closed cup

ppe

Eyeshields, Gloves, type P3 (EN 143) respirator cartridges

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