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Acetanilide-[d6]

General Information
Catalog: BLP-010667
CAS: 141801-46-9
Molecular Formula: C8H3D6NO
Molecular Weight: 141.20
Chemical Structure
Acetanilide-[d6]
Description Acetanilide-[d6] is the labelled analogue of Acetanilide, which is an impurity of Acetaminophen.
Synonyms Acetanilide D6; N-(Phenyl-d6)-acetamide; Acetamidobenzene-d6; Acetanil-d6; Acetoanilide-d6; NSC 203231-d6; NSC 7636-d6; Phenalgene-d6; USP Acetaminophen Related Compound D-d6; Paracetamol EP Impurity D-d6
IUPAC Name N-deuterio-N-(2,3,4,5,6-pentadeuteriophenyl)acetamide
Related CAS 103-84-4 (unlabelled)
Isomeric SMILES [2H]C1=C(C(=C(C(=C1[2H])[2H])N([2H])C(=O)C)[2H])[2H]
Canonical SMILES CC(=O)NC1=CC=CC=C1
InChI InChI=1S/C8H9NO/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)/i2D,3D,4D,5D,6D/hD
InChI Key FZERHIULMFGESH-TYSUPAQWSA-N
Boiling Point 304.5°C at 760 mmHg
Melting Point 112-115°C
Purity 95%
Density 1.153 g/cm3
Solubility Soluble in Dichloromethane, Ethyl Acetate, Methanol
Appearance White Crystalline Solid
Application N-D readily exchanges in protic solvents.
Storage Store at -20°C under inert atmosphere

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