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Merck
CN

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

Key Documents

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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

Related Categories

General description

1,3-Dinitrobenzene-d4 98 atom % D is a high-purity isotope product with a unique chemical profile that belongs to the class of isotopes. Produced by Sigma-Aldrich, we are committed to providing quality isotope products and a reliable supply chain. Available in industrial and pre-pack quantities.

Application

- Deuterium labeling for metabolic and pharmacokinetic studies
- synthesis of deuterated reference standards
- Isotope effect investigations in reaction mechanisms
- Chemical synthesis of labeled compounds

Features and Benefits

Features
- High isotopic purity for accurate results
- Stable under various experimental conditions
- Compatible with a wide range of chemical reactions
- Provides clear insights in complex systems

Benefits
- Facilitates Advanced research methodologies
- Provides reliable data for environmental studies
- Enhances the understanding of chemical processes
- Supports the development of innovative applications

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.

Signal Word

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 Code

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

WGK

WGK 3

Flash Point(F)

302.0 °F - closed cup

Flash Point(C)

150.00 °C - closed cup

Regulatory Information

非剧毒-急性毒性1
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Certificates of Analysis (COA)

Lot/Batch Number
IG0174
05012TY
IG0205

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