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3-Nitrobenzoic Acid-[d4]

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General Information
Catalog: BLP-010493
CAS: 78399-78-7
Molecular Formula: C7HD4NO4
Molecular Weight: 171.15

Chemical Structure

Synonyms	3-Nitrobenzoic-d4 Acid; m-Nitrobenzoic-d4 Acid; NSC 9801-d4; m-Carboxynitrobenzene-d4; m-Nitrobenzenecarboxylic-d4 Acid
IUPAC Name	2,3,4,6-tetradeuterio-5-nitrobenzoic acid
Related CAS	121-92-6 (unlabelled)
Canonical SMILES	C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
InChI	InChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)/i1D,2D,3D,4D
InChI Key	AFPHTEQTJZKQAQ-RHQRLBAQSA-N
Melting Point	140-142°C
Purity	98%; ≥99% atom D
Solubility	Slightly soluble in Chloroform, Methanol (Heated)
Appearance	White Solid
Storage	Store at 2-8°C