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Ethyl acetoacetate-[4-13C]

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General Information
Catalog: BLP-011146
CAS: 100548-44-5
Molecular Formula: C5[13C]H10O3
Molecular Weight: 131.13

Chemical Structure

Synonyms	Ethyl acetoacetate-4-13C
IUPAC Name	ethyl 3-oxo(4-13C)butanoate
Related CAS	141-97-9 (unlabelled)
Isomeric SMILES	CCOC(=O)CC(=O)[13CH3]
Canonical SMILES	CCOC(=O)CC(=O)C
InChI	InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3/i2+1
InChI Key	XYIBRDXRRQCHLP-VQEHIDDOSA-N
Boiling Point	181°C (lit.)
Melting Point	−43°C (lit.)
Purity	99% by CP; 99% atom 13C
Density	1.037 g/cm3 at 25°C
Storage	Store at 2-8°C