C6H4N2O4
172.13 g/mol
Research ReagentDanger
1,3-Dinitrobenzene-d4
CAS54247-05-1
Category
Research Reagent
Compound Class
Aromatic
Primary Use
Research Compound
1,3-Dinitrobenzene-d4 is a deuterium-labeled version of 1,3-dinitrobenzene, where the four hydrogen atoms on the aromatic ring are replaced by deuterium. It is primarily used as an isotopically labeled internal standard in analytical chemistry and mass spectrometry for quantitative analysis.
Isotopically labeled internal standard for mass spectrometryReference standard for quantitative analytical methods
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 54247-05-1
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Safety Reference
Danger
H300Fatal if swallowed
H310Fatal in contact with skin
H330Fatal if inhaled
H373May cause damage to organs through prolonged or repeated exposure
H400Very toxic to aquatic life
H410Very toxic to aquatic life with long lasting effects
Identifiers
IUPAC Name
1,2,3,5-tetradeuterio-4,6-dinitrobenzene
InChIKey
WDCYWAQPCXBPJA-RHQRLBAQSA-N
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[N+](=O)[O-])[2H])[N+](=O)[O-])[2H]
Synonyms (8)
- 1,3-Dinitrobenzene (D4, 98%)
- 1,3-Dinitrobenzene-d
- 1,3-Dinitrobenzene-d4
- m-Dinitrobenzene-d4