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Melatonin-[d4]

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General Information
Catalog: BLP-012674
CAS: 66521-38-8
Molecular Formula: C13H12D4N2O2
Molecular Weight: 236.30

Chemical Structure

Description	Melatonin-[d4] is the labelled analogue of Melatonin. Melatonin is a hormone in humans' body to control our sleep.
Synonyms	Melatonin-d4; N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]acetamide-d4
IUPAC Name	N-[1,1,2,2-tetradeuterio-2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide
Related CAS	73-31-4 (unlabelled)
Isomeric SMILES	[2H]C([2H])(C1=CNC2=C1C=C(C=C2)OC)C([2H])([2H])NC(=O)C
Canonical SMILES	CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC
InChI	InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)/i5D2,6D2
InChI Key	DRLFMBDRBRZALE-NZLXMSDQSA-N
Boiling Point	512.8±40.0 °C at 760 mmHg
Melting Point	104-107°C
Purity	95% by HPLC; 95% atom D
Density	1.2±0.1 g/cm3
Solubility	Soluble in Chloroform, Methanol
Appearance	Off-white to Beige Solid