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117501

2,6-Dinitrobenzaldehyde

98%

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About This Item

Linear Formula:
(O2N)2C6H3CHO
CAS Number:
606-31-5
Molecular Weight:
196.12
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24847333
EC Number:
210-113-9
Beilstein/REAXYS Number:
2113951
MDL number:
MFCD00007133
Assay:
98%
Form:
solid
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Quality Level

200

assay

98%

form

solid

mp

120-122 °C (lit.)

functional group

aldehyde, nitro

storage temp.

2-8°C

SMILES string

[H]C(=O)c1c(cccc1[N+]([O-])=O)[N+]([O-])=O

InChI

1S/C7H4N2O5/c10-4-5-6(8(11)12)2-1-3-7(5)9(13)14/h1-4H

InChI key

WHFZQNNDIJKLIO-UHFFFAOYSA-N

General description

2,6-Dinitrobenzaldehyde is the major intermediate formed by the combined ozonation of 2,6-dinitrotoluene with hydrogen peroxide and UV radiation.

Application

2,6-Dinitrobenzaldehyde was used in the synthesis of free base tetrakis(2,6-dinitrophenyl) porphyrin.

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

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Certificates of Analysis (COA)

Lot/Batch Number
0000496450
0000496450
0000426363
0000426363
0000040007

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M Mori et al.
Xenobiotica; the fate of foreign compounds in biological systems, 19(7), 731-741 (1989-07-01)
1. Unchanged 2,6-dinitrotoluene (2,6-DNT), 2-amino-6-nitrotoluene, 2,6-dinitrobenzyl alcohol, 2-amino-6-nitrobenzyl alcohol, conjugated 2,6-dinitrobenzyl alcohol and conjugated 2-amino-6-nitrobenzyl alcohol were detected in urine of male Wistar rats dosed with 2,6-DNT. The major metabolite was conjugated 2,6-dinitrobenzyl alcohol, which accounted for about 1.5% of
Synthesis and spectroscopic characterization of bis-pocket porphyrins: tetrakis (2', 6'-dinitrophenyl) porphyrin and catalytic activity of a manganese (III) chloride derivative in alkane oxidation.
Quintana CA, et al.
Inorganic Chemistry, 28(18), 3421-3425 (1989)
Nitroaromatic hydrocarbon ozonation in water. 2. Combined ozonation with hydrogen peroxide or UV radiation.
Beltran FJ, et al
Industrial & Engineering Chemistry Research, 37(1), 32-40 (1998)
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Global Trade Item Number

SKUGTIN
117501-1G04061825921709