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61973-42-0

61973-42-0 Structure

61973-42-0 Structure
IdentificationBack Directory
[Name]

ETHYL ACETOACETATE (3-13C)
[CAS]

61973-42-0
[Synonyms]

ETHYL ACETOACETATE (3-13C)
ETHYL ACETOACETATE-3-13C, 99 ATOM % 13C
[Molecular Formula]

C6H10O3
[MDL Number]

MFCD00083953
[MOL File]

61973-42-0.mol
[Molecular Weight]

131.15
Chemical PropertiesBack Directory
[Melting point ]

-43 °C (lit.)
[Boiling point ]

181 °C (lit.)
[density ]

1.037 g/mL at 25 °C
[refractive index ]

n20/D 1.419(lit.)
[Fp ]

84 °C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38-41
[Safety Statements ]

26-36
[RIDADR ]

UN 1993 / PGIII
[WGK Germany ]

1
Hazard InformationBack Directory
[Uses]

Ethyl acetoacetate-13C is the 13C labeled Ethyl acetoacetate[1]. Ethyl acetoacetate (Ethyl acetylacetate) is an ester widely used as an intermediate in the synthesis of many varieties of compounds[2][3][4]. Ethyl acetoacetate is an inhibitor of bacterial biofilm[5].
[References]

[1] Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. DOI:10.1177/1060028018797110
[2] Rao M.Uppu, et al. Enantioselective catalytic asymmetric hydrogenation of ethyl acetoacetate in room temperature ionic liquids. Biochemical and Biophysical Research Communications. 1996 Dec; 229(3):764-769.
[3] Leo F. Salter, et al. A dual‐frequency Belousov Zhabotinskii oscillating reaction with ethyl acetoacetate as organic substrate. substrate. International Journal of Chemical Kinetics. 1982. 14(8), 815–821.
[4] Iqbal S, et al. 2-Oxo-1,2,3,4-tetrahydropyrimidines Ethyl Esters as Potent β- Glucuronidase Inhibitors: One-pot Synthesis, In vitro and In silico Studies. Med Chem. 201814(8):818-830. DOI:10.2174/1573406414666180525105325
[5] Horne SM, et al. Acetoacetate and ethyl acetoacetate as novel inhibitors of bacterial biofilm. Lett Appl Microbiol. 2018 Apr66(4):329-339. DOI:10.1111/lam.12852
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