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Key Documents

236284

Sigma-Aldrich

2-Nitroanisole

≥99%

Synonym(s):

1-Methoxy-2-nitrobenzene

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About This Item

Linear Formula:
O2NC6H4OCH3
CAS Number:
Molecular Weight:
153.14
Beilstein/REAXYS Number:
1868032
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

≥99%

form

liquid

refractive index

n20/D 1.561 (lit.)

bp

273 °C (lit.)

mp

9-12 °C (lit.)

solubility

alcohol: soluble(lit.)
diethyl ether: soluble(lit.)
water: insoluble(lit.)

density

1.254 g/mL at 25 °C (lit.)

SMILES string

COc1ccccc1[N+]([O-])=O

InChI

1S/C7H7NO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3

InChI key

CFBYEGUGFPZCNF-UHFFFAOYSA-N

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General description

2-Nitroanisole (2-methoxynitrobenzene is an industrial and environmental pollutant causing tumors of the urinary bladder in rats and mice. Tumorigenic potential of 2-nitroanisole has been evaluated by host-mediated in vitro and in vivo assay.

Application

2-Nitroanisole has been employed as solvatochromic probe to examine cybotactic region of pure and mixed supercritical fluid solvent systems.

pictograms

Exclamation markHealth hazard

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Carc. 1B

Storage Class

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

wgk_germany

WGK 3

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


Certificates of Analysis (COA)

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Characterization of supercritical fluid solvents using solvatochromic shifts.
Yonker CR, et al.
The Journal of Physical Chemistry, 90(13), 3022-3026 (1986)
Mohammad Asaduzzaman Miah et al.
Ecology and evolution, 7(14), 5032-5040 (2017-08-05)
Cytochrome P450 monooxygenases (CYPs) usually overexpressed in resistant strain were found involved in oxidative detoxification of insecticides. In this study, an investigation was conducted to confirm if resistance irrelevant CYPs which were not overexpressed in resistant strain before, were capable
T Prabhu et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 83(1), 8-16 (2011-10-04)
Fourier-transform Raman and infrared spectra of 2-nitroanisole are recorded (4000-100 cm(-1)) and interpreted by comparison with respective theoretical spectra calculated using HF and DFT method. The geometrical parameters with C(S) symmetry, harmonic vibrational frequencies, infrared and Raman scattering intensities are
Effects of physical binding of o-Nitroanisole with feed upon its systemic availability in male F344 rats.
J H Yuan et al.
Bulletin of environmental contamination and toxicology, 47(1), 152-159 (1991-07-01)
R D Irwin et al.
Fundamental and applied toxicology : official journal of the Society of Toxicology, 30(1), 1-12 (1996-03-01)
o-Nitroanisole, a mutagenic intermediate used in the manufacture of azo dyes, was administered in feed for 2 years at concentrations of 0, 222, 666, or 2000 ppm to groups of 60 male and 60 female F344 rats. No significant increase

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