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579130

4-Methoxy-2-nitrobenzonitrile

98%

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About This Item

Linear Formula:
CH3OC6H3(NO2)CN
CAS Number:
38469-83-9
Molecular Weight:
178.14
NACRES:
NA.22
PubChem Substance ID:
24880972
UNSPSC Code:
12352100
MDL number:
MFCD00667741
Assay:
98%
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assay

98%

mp

137-140 °C (lit.)

functional group

nitrile, nitro

SMILES string

COc1ccc(C#N)c(c1)[N+]([O-])=O

InChI

1S/C8H6N2O3/c1-13-7-3-2-6(5-9)8(4-7)10(11)12/h2-4H,1H3

InChI key

UUYPUFCWSUBTFP-UHFFFAOYSA-N

General description

4-Methoxy-2-nitrobenzonitrile can be prepared by reacting 3-nitro-4-bromoanisole with cuprous cyanide in dimethylformamide.

Application

4-Methoxy-2-nitrobenzonitrile may be used to synthesize, 4-methoxy-N′-(4-methoxyphenyl)-2-nitrobenzene-1-carboximidamideby heating with p-anisidine and trimethylaluminium in toluene.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKBC3887V
MKBC3887
MKBB0504
06430CH
09615BH

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?Reactivity of several deactivated 3-aminobenzo [b] thiophenes in the Buchwald?Hartwig C?N coupling. Scope and limitations"
Queiroz P.R.J-M, et al.
Tetrahedron, 63(52), 13000-13005 (2007)
?Organophosphorus-mediated N?N bond formation: facile access to 3-amino-2 H-indazoles"
Abed BH, et al.
Organic & Biomolecular Chemistry, 14(36), 8520-8528 (2016)

Global Trade Item Number

SKUGTIN
579130-5G04061832101125