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2-Nitrobenzaldehyde-[d4]

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General Information
Catalog: BLP-010427
CAS: 1020718-69-7
Molecular Formula: C7HD4NO3
Molecular Weight: 155.14

Chemical Structure

Synonyms	2-Nitrobenzaldehyde D4; 1-Formyl-2-nitrobenzene-d4; 2-Formyl-3-nitrobenzene-d4; NSC 5713-d4; 2-NBA-d4; o-Nitrobenzaldehyde-d4; 2-Nitrobenzenecarboxaldehyde-d4
IUPAC Name	2,3,4,5-tetradeuterio-6-nitrobenzaldehyde
Related CAS	552-89-6 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])C=O)[N+](=O)[O-])[2H])[2H]
Canonical SMILES	C1=CC=C(C(=C1)C=O)[N+](=O)[O-]
InChI	InChI=1S/C7H5NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H/i1D,2D,3D,4D
InChI Key	CMWKITSNTDAEDT-RHQRLBAQSA-N
Melting Point	41-42°C
Purity	98%; ≥99% atom D
Solubility	Slightly soluble in Chloroform, Ethyl Acetate
Appearance	Pale Yellow Solid
Storage	Store at -20°C under inert atmosphere