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Acetanilide-[Ring-13C6]

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General Information
Catalog: BLP-009169
CAS: 201741-03-9
Molecular Formula: C2[13C]6H9NO
Molecular Weight: 141.12

Chemical Structure

Description	Acetanilide-[Ring-13C6] is a labelled impurity of Acetaminophen.
Synonyms	N-Phenyl-acetamide-13C6; N-Acetyl-benzenamine-13C6; Antifebrin-13C6; Acetoanilide-13C6; NSC 203231-13C6; NSC 7636-13C6; Phenalgene-13C6; Phenalgin-13C6
IUPAC Name	N-((1,2,3,4,5,6-13C6)cyclohexatrienyl)acetamide
Related CAS	103-84-4 (unlabelled)
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)/i2+1,3+1,4+1,5+1,6+1,8+1
InChI Key	FZERHIULMFGESH-OLGKHRKTSA-N
Boiling Point	304°C (lit.)
Melting Point	113-115°C (lit.)
Purity	95%
Density	1.274 g/cm3
Solubility	Soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol
Appearance	White Solid