Ethyl benzoylacetate

ALDRICH/12990 - technical, ≥95% (HPLC)

Synonym: Benzoylacetic acid ethyl ester; Ethyl 3-oxo-3-phenylpropionate

CAS Number: 94-02-0
Empirical Formula (Hill Notation): C₁₁H₁₂O₃
Molecular Weight: 192.21
EC Number: 202-295-3
MDL Number: MFCD00009196
Linear Formula: C₆H₅COCH₂COOC₂H₅
Product Type: Chemical

Catalog Number	PKG Qty.	Price


45-12990-100ML	100 mL	$77.90 1/EAAdd To Favorites	Add To Favorites
45-12990-500ML	500 mL	$0.00 1/EA CALL FOR PRICEAdd To Favorites	Add To Favorites

assay	≥95% (HPLC)
bp	265-270 °C (lit.)
density	1.11 g/mL at 25 °C (lit.)
form	liquid
functional group	ester
	ketone
	phenyl
grade	technical
InChI	1S/C11H12O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3
InChI key	GKKZMYDNDDMXSE-UHFFFAOYSA-N
Quality Level	100
refractive index	n20/D 1.52 (lit.)
	n20/D 1.520-1.540
SMILES string	CCOC(=O)CC(=O)c1ccccc1
solubility	alcohol: miscible
	diethyl ether: miscible
	H₂O: insoluble
vapor density	6.6 (vs air)

Application:	Ethyl benzoylacetate (Benzoylacetic acid ethyl ester) was used to prepare ethyl 2-fluoro-2-benzolyacetate. It was also used to synthesize iodonium ylides.
Packaging:	100, 500 mL in glass bottle

RIDADR	NONH for all modes of transport
WGK Germany	WGK 2
Flash Point(F)	284.0 °F - closed cup
Flash Point(C)	140 °C - closed cup

Purity	≥95% (HPLC)
bp	265-270 °C (lit.)
Density	1.11 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.52 (lit.); n20/D 1.520-1.540
UNSPSC	12352100