Skip to Content
Merck
All Photos(1)

Documents

F10801

Sigma-Aldrich

1-Fluoro-2-nitrobenzene

99%

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
FC6H4NO2
CAS Number:
1493-27-2
Molecular Weight:
141.10
Beilstein:
607262
EC Number:
216-088-0
MDL number:
MFCD00007048
UNSPSC Code:
12352100
PubChem Substance ID:
24894745
NACRES:
NA.22

Assay

99%

form

liquid

refractive index

n20/D 1.532 (lit.)

bp

116 °C/22 mmHg (lit.)

mp

−9-−6 °C (lit.)

density

1.338 g/mL at 25 °C (lit.)

SMILES string

[O-][N+](=O)c1ccccc1F

InChI

1S/C6H4FNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H

InChI key

PWKNBLFSJAVFAB-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 2 - STOT RE 1

Storage Class Code

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point(F)

201.2 °F - closed cup

Flash Point(C)

94 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

V Udayakumar et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 83(1), 575-586 (2011-10-01)
FT-IR and FT-Raman spectra of p-fluoronitrobenzene (FNO(2)C(6)H(4)) have been recorded in the region 4000-100 cm(-1). In this work, the experimental and theoretical spectra of p-fluoronitrobenzene (p-FNBz) are studied. The molecular geometry and vibrational frequencies are calculated in the ground state
Kathryn E O'Harra et al.
Membranes, 9(7) (2019-07-07)
Three new isomeric 6FDA-based polyimide-ionenes, with imidazolium moieties and varying regiochemistry (para-, meta-, and ortho- connectivity), and composites with three different ionic liquids (ILs) have been developed as gas separation membranes. The structural-property relationships and gas separation behaviors of the
S Ramalingam et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 94, 318-330 (2012-04-27)
In the present investigation, the FT-IR/FT-Raman spectra of the m-fluoronitrobenzene (m-FNBZ) are recorded. The fundamental frequencies are assigned and the computational calculations are performed by DFT (B3LYP, B3PW91 and MPW1PW91) methods with 6-31++G(d,p) and 6-311++G(d,p) basis sets and the corresponding
Krishnananda Samanta et al.
Organic & biomolecular chemistry, 8(12), 2823-2828 (2010-04-24)
A new series of enantiomerically pure 2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoxalines were synthesized for the first time in twelve steps from 1-fluoro-2-nitrobenzene and S-amino acids with 13-20% overall yields. First use of intramolecular Mitsunobu cyclization for 1,2,3,4-tetrahydroquinoxalines followed by PPh(3)/I(2)/imidazole mediated 6-exo-tet cyclization were
V Arjunan et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 84(1), 196-209 (2011-10-14)
Experimental FTIR, FT-Raman and FT-NMR spectroscopic studies of o-fluoronitrobenzene and p-fluoronitrobenzene have been carried out. A detailed quantum chemical calculations have been performed using DFT/B3LYP method with 6-311++G** and 6-31G** basis sets. Complete vibrational analyses of the compounds were performed.
View All Related Papers

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service