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N-Methyl-[d3]-2-pyrrolidinone-[d6]

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General Information
Catalog: BLP-001096
CAS: 185964-60-7
Molecular Formula: C5D9NO
Molecular Weight: 108.19

Chemical Structure

Description	N-Methyl-[d3]-2-pyrrolidinone-[d6] is a labelled analogue of 1-Methyl-2-pyrrolidinone. N-Methyl-2-pyrrolidone is used as a versatile industrial solvent.
Synonyms	1-Methyl-d3-2-pyrrolidinone-d6; Deuterated methylpyrrolidinone
IUPAC Name	3,3,4,4,5,5-hexadeuterio-1-(trideuteriomethyl)pyrrolidin-2-one
Related CAS	872-50-4 (unlabelled)
Isomeric SMILES	[2H]C1(C(=O)N(C(C1([2H])[2H])([2H])[2H])C([2H])([2H])[2H])[2H]
Canonical SMILES	CN1CCCC1=O
InChI	InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3/i1D3,2D2,3D2,4D2
InChI Key	SECXISVLQFMRJM-YNSOAAEFSA-N
Boiling Point	202 °C (lit.)
Melting Point	-24° C
Purity	99% by CP; 98% atom D
Density	1.125 g/mL at 25 °C
Solubility	Soluble in water, chloroform (unlabeled), and methanol (unlabeled).