402729
2-Methyl-5-nitroaniline
95%
Synonym(s):
2-Amino-4-nitrotoluene, 5-Nitro-o-toluidine
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About This Item
Linear Formula:
CH3C6H3(NO2)NH2
CAS Number:
Molecular Weight:
152.15
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-765-8
Beilstein/REAXYS Number:
879021
MDL number:
Assay:
95%
Form:
powder
assay
95%
form
powder
mp
103-106 °C (lit.)
functional group
nitro
SMILES string
Cc1ccc(cc1N)[N+]([O-])=O
InChI
1S/C7H8N2O2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,8H2,1H3
InChI key
DSBIJCMXAIKKKI-UHFFFAOYSA-N
General description
2-Methyl-5-nitroaniline is one of the laser-induced decomposition product of Pigment Red 22 and Pigment Red 9 (widely used azo compound). The electron charge distribution of 2-methyl-5-nitroaniline has been investigated from high-resolution single crystal X-ray data and ab initio calculations. Electroantennogram (EAG) response profile of different insect species to 2-methyl-5-nitroaniline has been investigated.
Application
2-Methyl-5-nitroaniline may be employed as analytical standard for the surfactant mediated transformations (−254nm) of 2,4-dinitrotoluene.
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signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 3 - Carc. 2
Storage Class
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
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