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4-(Methylnitrosamino)-4-(3-Pyridyl)-1-Butanol-[d3]

General Information
Catalog: BLP-012173
CAS: 1184990-35-9
Molecular Formula: C10H12D3N3O2
Molecular Weight: 212.26
Chemical Structure
4-(Methylnitrosamino)-4-(3-Pyridyl)-1-Butanol-[d3]
Synonyms 4-[N-(Methyl-d3)-N-nitrosamino]-4-(3-pyridyl)butane-1-ol
IUPAC Name N-(4-hydroxy-1-pyridin-3-ylbutyl)-N-(trideuteriomethyl)nitrous amide
Related CAS 59578-66-4 (unlabelled)
Canonical SMILES CN(C(CCCO)C1=CN=CC=C1)N=O
InChI InChI=1S/C10H15N3O2/c1-13(12-15)10(5-3-7-14)9-4-2-6-11-8-9/h2,4,6,8,10,14H,3,5,7H2,1H3/i1D3
InChI Key IIDMFFRDEFHWCJ-FIBGUPNXSA-N
Boiling Point 428.9±45.0 °C at 760 mmHg
Purity 95% atom D
Density 1.2±0.1 g/cm3
Solubility Soluble in Chloroform, Methanol
Appearance Colorless to Yellow Oil to Thick Oil
Application A toxic and carcinogenic labelled agent in dry and moist snuff.
Storage Store at -20°C

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