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Phthalic acid-[3,4,5,6-d4]

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General Information
Catalog: BLP-010059
CAS: 87976-26-9
Molecular Formula: C8H2D4O4
Molecular Weight: 170.16

Chemical Structure

Synonyms	Phthalic acid-phenyl-d4; 1,2-(Benzene-d4)dicarboxylic Acid; NSC 5348-d4; Sunftal 20-d4; o-(Benzene-d4)dicarboxylic Acid; o-Carboxybenzoic Acid-d4; o-Dicarboxybenzene-d4
IUPAC Name	3,4,5,6-tetradeuteriophthalic acid
Related CAS	88-99-3 (unlabelled)
Canonical SMILES	C1=CC=C(C(=C1)C(=O)O)C(=O)O
InChI	InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)/i1D,2D,3D,4D
InChI Key	XNGIFLGASWRNHJ-RHQRLBAQSA-N
Boiling Point	378.3°C at 760 mmHg
Melting Point	210-211°C (lit.)
Purity	≥98% by CP; ≥98% atom D
Density	1.486g/cm3
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White to Off-white Solid
Application	Organic reagent used to synthesize phthalates
Storage	Store at RT