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4-Methyl-2-pentanone-[d5]

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General Information
Catalog: BLP-010959
CAS: 4840-81-7
Molecular Formula: C6H7D5O
Molecular Weight: 105.19

Chemical Structure

Description	4-Methyl-2-pentanone-[d5] is an isotope analogue of 4-Methyl-2-pentanone. 4-Methyl-2-pentanone is used as a solvent and 4-Methyl-2-pentanone is also a reactant used to synthesize 2-(1-Hydroxy-3-methylbutylidene)-1H-indene-1,3(2H)-dione.
Synonyms	4-Methyl-2-pentanone-1,1,1,3,3-d5
IUPAC Name	1,1,1,3,3-pentadeuterio-4-methylpentan-2-one
Related CAS	108-10-1 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])C(=O)C([2H])([2H])C(C)C
Canonical SMILES	CC(C)CC(=O)C
InChI	InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3/i3D3,4D2
InChI Key	NTIZESTWPVYFNL-IKISXXDZSA-N
Boiling Point	117-118°C (lit.)
Purity	99% by CP; 98% atom D
Density	0.841 g/cm3 at 25°C