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Ethyl acetoacetate-[2,4-13C2]

General Information
Catalog: BLP-009274
CAS: 77504-74-6
Molecular Formula: C4[13C]2H10O3
Molecular Weight: 132.13
Chemical Structure
Ethyl acetoacetate-[2,4-13C2]
Description Ethyl acetoacetate-[2,4-13C2] is the labelled analogue of Ethyl Acetate, which is a chemical intermediate used in the production of various analgesics, antibiotics and antimalarial agents.
Synonyms Ethyl 3-oxobutanoate-2,4-13C2; ethyl 3-oxo(2,4-13C2)butanoate
IUPAC Name ethyl 3-oxo(2,4-13C2)butanoate
Related CAS 141-97-9 (unlabelled)
Isomeric SMILES CCOC(=O)[13CH2]C(=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+1,4+1
InChI Key XYIBRDXRRQCHLP-NDLBAUGKSA-N
Boiling Point 181°C (lit.)
Melting Point −43°C (lit.)
Purity 99% by CP; 99% atom 13C
Density 1.045 g/cm3

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