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Monopropyl Phthalate-[d4]

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General Information
Catalog: BLP-004799
CAS: 1795020-91-5
Molecular Formula: C11H8D4O4
Molecular Weight: 212.23

Chemical Structure

Synonyms	mono-n-Propyl Phthalate D4; 1,2-(Benzene-d4)dicarboxylic Acid 1-Propyl Ester; 1,2-(Benzene-d4)dicarboxylic Acid Monopropyl Ester; Phthalic Acid-d4 Monopropyl Ester; Phthalic Acid-d4 Propyl Ester; Mono-n-propyl phthalate-d4; NSC 309966-d4
IUPAC Name	2,3,4,5-tetradeuterio-6-propoxycarbonylbenzoic acid
Related CAS	4376-19-6 (unlabelled)
Canonical SMILES	CCCOC(=O)C1=CC=CC=C1C(=O)O
InChI	InChI=1S/C11H12O4/c1-2-7-15-11(14)9-6-4-3-5-8(9)10(12)13/h3-6H,2,7H2,1H3,(H,12,13)/i3D,4D,5D,6D
InChI Key	NFOQRIXSEYVCJP-LNFUJOGGSA-N
Melting Point	56-58°C
Purity	≥99%; ≥99% atom D
Solubility	Slightly soluble in DMSO, Methanol
Appearance	White Solid
Storage	Store at 2-8°C