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F10801

Sigma-Aldrich

1-Fluoro-2-nitrobenzene

99%

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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

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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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

FSL

Group 5: Self-reactive substances
Nitro compounds
Hazardous rank I
1st self-reactive materials

JAN Code

F10801-50G:
F10801-250G:
F10801-10G:
F10801-BULK:
F10801-VAR:

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Certificates of Analysis (COA)

Lot/Batch Number
BCCH3951
BCCF0294
BCCC1501
BCBW8464
BCBT1847

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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.
N Tuset et al.
Allergologia et immunopathologia, 14(6), 489-497 (1986-11-01)
The multi-functionality of a given antibody, even monoclonal antibody has recently been shown; this raises the possibility that the specificity of an antiserum be due to a population phenomena; i.e., the specificity would be the net result of the affinity
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
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
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
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