559091
Ethyl (2-chlorobenzoyl)acetate
≥95%
Synonym(s):
Ethyl (o-chlorobenzoyl)acetate, Ethyl 3-(2-chlorophenyl)-3-oxopropanoate, NSC 158136
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About This Item
Linear Formula:
ClC6H4COCH2CO2C2H5
CAS Number:
Molecular Weight:
226.66
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
≥95%
assay
≥95%
InChI
1S/C11H11ClO3/c1-2-15-11(14)7-10(13)8-5-3-4-6-9(8)12/h3-6H,2,7H2,1H3
SMILES string
CCOC(=O)CC(=O)c1ccccc1Cl
InChI key
DLFBNTUSDQSFOF-UHFFFAOYSA-N
refractive index
n20/D 1.540 (lit.)
bp
221-222 °C (lit.)
density
1.206 g/mL at 25 °C (lit.)
functional group
chloro, ester, ketone
Quality Level
Related Categories
Application
Ethyl (2-chlorobenzoyl)acetate may be used to synthesize ketosplitomicin derivative and ethyl 6-(2-chlorophenyl)-2,2-dimethyl-4-oxo-2,3-dihydro-4Hpyran-5-carboxylate.
Reactant for:
- Cerium ammonium nitrate-mediated oxidative coupling
- Hydrosilylation reactions
- Preparation of diaryl-substituted pyrazoles as potent CCR2 receptor antagonists
- Preparation of potential herbicidal agents
- Ruthenium-catalyzed asymmetric hydrogenation
Storage Class
10 - Combustible liquids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves
Regulatory Information
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Characterization of sirtuin inhibitors in nematodes expressing a muscular dystrophy protein reveals muscle cell and behavioral protection by specific sirtinol analogues.
Pasco MY, et al.
Journal of Medicinal Chemistry, 53(3), 1407-1411 (2009)
Simple access to 5-carboalkoxy-2, 3-dihydro-4H-pyran-4-ones via domino acylative electrocyclization: the first three step total synthesis of the dihydronaphthopyran-4-one class of natural products.
Ilangovan A and Sakthivel P.
Royal Society of Chemistry Advances, 4(98), 55150-55161 (2014)
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