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Monobenzyl Phthalate-[d4]

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General Information
Catalog: BLP-011957
CAS: 478954-83-5
Molecular Formula: C15H8D4O4
Molecular Weight: 260.28

Chemical Structure

Description	N-Benzoylglycine, also known as Hippuric Acid, is the glycine conjugate of benzoic acid commonly found in ruminant urine. Hippuric acid is synthesized in the liver and its production is greatly increased following consumption of benzoic acid. In itself it does not have a direct biological function, however p-hydroxy-hippurica acid can be used as an inhibitor of Ca2+ ATPase. A possible biomarker of Parkinson's disease.
Synonyms	Monobenzyl Phthalate D4; 2-[(Benzyloxy)carbonyl](2H4)benzoic acid
IUPAC Name	2,3,4,5-tetradeuterio-6-phenylmethoxycarbonylbenzoic acid
Related CAS	2528-16-7 (unlabelled)
Isomeric SMILES	[2H]C1=C(C(=C(C(=C1[2H])C(=O)O)C(=O)OCC2=CC=CC=C2)[2H])[2H]
Canonical SMILES	C1=CC=C(C=C1)COC(=O)C2=CC=CC=C2C(=O)O
InChI	InChI=1S/C15H12O4/c16-14(17)12-8-4-5-9-13(12)15(18)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)/i4D,5D,8D,9D
InChI Key	XIKIUQUXDNHBFR-DOGSKSIHSA-N
Boiling Point	470.8±25.0 °C at 760 mmHg
Melting Point	103-105°C
Purity	98% atom D
Density	1.2±0.1 g/cm3
Solubility	Soluble in Chloroform, DMSO, Methanol
Appearance	White Solid
Application	N-Benzoylglycine also known as Hippuric Acid is the glycine conjugate of benzoic acid commonly found in ruminant urine. It is synthesized in the liver and its production is greatly increased following consuption of benzoic acid. In itself it does not have
Storage	Store at -20°C