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3-Methyl Hippuric Acid-[d7]

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General Information
Catalog: BLP-011967
CAS: 1216551-07-3
Molecular Formula: C10H4D7NO3
Molecular Weight: 200.24

Chemical Structure

Synonyms	N-(3-Methyl-d3-benzoyl-d4)glycine; N-(3-Methyl-d3-benzoyl-d4)glycine
IUPAC Name	2-[[2,3,4,6-tetradeuterio-5-(trideuteriomethyl)benzoyl]amino]acetic acid
Related CAS	27115-49-7 (unlabelled)
Canonical SMILES	CC1=CC(=CC=C1)C(=O)NCC(=O)O
InChI	InChI=1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)/i1D3,2D,3D,4D,5D
InChI Key	YKAKNMHEIJUKEX-AAYPNNLASA-N
Boiling Point	418.5±38.0 °C at 760 mmHg
Melting Point	140-141°C
Purity	95% atom D
Density	1.2±0.1 g/cm3
Solubility	Soluble in DMSO, Methanol
Appearance	White to Off-white Solid
Storage	Store at -20°C