559180
(3-甲基苯甲酰基)乙酸乙酯
别名:
3-Oxo-3-(m-tolyl)propionic acid ethyl ester, Ethyl 2-(3-methylbenzoyl)acetate, Ethyl 3-oxo-3-(m-tolyl)propanoate, Ethyl 3-oxo-3-(m-tolyl)propionate, Ethyl m-methylbenzoylacetate, Ethyl m-toluoylacetate
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关于此项目
线性分子式:
CH3C6H4COCH2CO2CH2CH3
化学文摘社编号:
分子量:
206.24
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
refractive index
n20/D 1.5290 (lit.)
Quality Segment
bp
273-274 °C (lit.)
density
1.083 g/mL at 25 °C (lit.)
functional group
ester, ketone
SMILES string
CCOC(=O)CC(=O)c1cccc(C)c1
InChI
1S/C12H14O3/c1-3-15-12(14)8-11(13)10-6-4-5-9(2)7-10/h4-7H,3,8H2,1-2H3
InChI key
LLFKVNDSLHMEQC-UHFFFAOYSA-N
Application
Reactant for:
- Stereoselective ketonization-olefination of indoles by Co/Mn-mediated oxidative cross-coupling of indoles via dioxygen activation
- Enantioselective Michael reaction
- SEGPhos-ruthenium-catalyzed asymmetric hydrogenation
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves