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Merck
CN

306010

3,5-Difluoronitrobenzene

99%

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About This Item

Linear Formula:
F2C6H3NO2
CAS Number:
Molecular Weight:
159.09
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
218-867-0
MDL number:
Assay:
99%
Form:
liquid
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assay

99%

form

liquid

refractive index

n20/D 1.499 (lit.)

bp

176-177 °C (lit.)

mp

17 °C (lit.)

density

1.407 g/mL at 25 °C (lit.)

functional group

fluoro

SMILES string

[O-][N+](=O)c1cc(F)cc(F)c1

InChI

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

InChI key

AUQBBDWDLJSKMI-UHFFFAOYSA-N

General description

Molecular structure of 3,5-difluoronitrobenzene was studied by gas-phase electron diffraction, MP2 ab initio and by B3LYP density functional calculations.


pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

165.2 °F - closed cup

flash_point_c

74 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter



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