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389366

Sigma-Aldrich

1,3-Dinitrobenzene-d4

98 atom % D

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About This Item

Linear Formula:
C6D4(NO2)2
CAS Number:
54247-05-1
Molecular Weight:
172.13
MDL number:
MFCD00084139
UNSPSC Code:
12352005
PubChem Substance ID:
24864277
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

200

form

solid

bp

297 °C (lit.)

mp

88-90 °C (lit.)

mass shift

M+4

SMILES string

[2H]c1c([2H])c(c([2H])c(c1[2H])[N+]([O-])=O)[N+]([O-])=O

InChI

1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H/i1D,2D,3D,4D

InChI key

WDCYWAQPCXBPJA-RHQRLBAQSA-N

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

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Danger

Hazard Classifications

Acute Tox. 1 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - STOT RE 2

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk_germany

WGK 3

flash_point_f

302.0 °F - closed cup

flash_point_c

150.00 °C - closed cup

Certificates of Analysis (COA)

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