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N-Acetyl-S-Benzyl-L-Cysteine-[d3]

General Information
Catalog: BLP-011970
CAS: 201404-15-1
Molecular Formula: C12H12D3NO3S
Molecular Weight: 256.34
Chemical Structure
N-Acetyl-S-Benzyl-L-Cysteine-[d3]
Synonyms N-(Acetyl-d3)-S-benzyl-L-cysteine; S-Benzyl-N-(2H3)ethanoyl-L-cysteine
IUPAC Name (2R)-3-benzylsulfanyl-2-[(2,2,2-trideuterioacetyl)amino]propanoic acid
Related CAS 19542-77-9 (unlabelled)
Canonical SMILES CC(=O)NC(CSCC1=CC=CC=C1)C(=O)O
InChI InChI=1S/C12H15NO3S/c1-9(14)13-11(12(15)16)8-17-7-10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3,(H,13,14)(H,15,16)/t11-/m0/s1/i1D3
InChI Key BJUXDERNWYKSIQ-DCLJDFQTSA-N
Boiling Point 506.2±50.0 °C at 760 mmHg
Melting Point 140-142°C
Purity 95% atom D
Density 1.2±0.1 g/cm3
Solubility Soluble in DMSO, Methanol
Appearance White to Off-white Solid
Application A labelled metabolite of Toluene.
Storage Store at -20°C

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