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2-Nitrotoluene-[d7]

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General Information
Catalog: BLP-010430
CAS: 84344-04-7
Molecular Formula: C7D7NO2
Molecular Weight: 144.18

Chemical Structure

Synonyms	2-Nitrotoluene D7; 5-(Methyl-d3)-6-nitro-benzene-1,2,3,4-d4; 1-Methyl-2-nitrobenzene-d7; 2-Methyl-1-nitrobenzene-d7; 2-Methylnitrobenzene-d7; NSC 9577-d7; o-Methylnitrobenzene-d7; o-Mononitrotoluene-d7
IUPAC Name	1,2,3,4-tetradeuterio-5-nitro-6-(trideuteriomethyl)benzene
Related CAS	88-72-2 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])C([2H])([2H])[2H])[N+](=O)[O-])[2H])[2H]
Canonical SMILES	CC1=CC=CC=C1[N+](=O)[O-]
InChI	InChI=1S/C7H7NO2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3/i1D3,2D,3D,4D,5D
InChI Key	PLAZTCDQAHEYBI-AAYPNNLASA-N
Purity	≥95%; ≥99% atom D
Solubility	Soluble in Dichloromethane, Ethanol, Ethyl Acetate
Appearance	Yellow Oily Matter
Storage	Store at 2-8°C