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3-Methyl Hippuric Acid-[d7]

General Information
Catalog: BLP-011967
CAS: 1216551-07-3
Molecular Formula: C10H4D7NO3
Molecular Weight: 200.24
Chemical Structure
3-Methyl Hippuric Acid-[d7]
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

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