Ethyl 3-(3-nitrophenyl)-3-oxopropanoate

Modify Date: 2025-08-24 14:33:10

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure
Ethyl 3-(3-nitrophenyl)-3-oxopropanoate structure
Common Name Ethyl 3-(3-nitrophenyl)-3-oxopropanoate
CAS Number 52119-38-7 Molecular Weight 237.209
Density 1.3±0.1 g/cm3 Boiling Point 314.4±17.0 °C at 760 mmHg
Molecular Formula C11H11NO5 Melting Point 75-77 °C(lit.)
MSDS Chinese USA Flash Point 129.3±22.9 °C

 Names

Name Ethyl 3-(3-nitrophenyl)-3-oxopropanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 314.4±17.0 °C at 760 mmHg
Melting Point 75-77 °C(lit.)
Molecular Formula C11H11NO5
Molecular Weight 237.209
Flash Point 129.3±22.9 °C
Exact Mass 237.063721
PSA 89.19000
LogP 1.70
Vapour Pressure 0.0±0.7 mmHg at 25°C
Index of Refraction 1.542
Storage condition 2-8°C

 Safety Information

Hazard Codes Xi: Irritant;
RIDADR NONH for all modes of transport
WGK Germany 3
HS Code 2918300090

 Synthetic Route

~95%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: LEGOCHEM BIOSCIENCE LTD. Patent: WO2008/69609 A1, 2008 ; Location in patent: Page/Page column 22-23 ; WO 2008/069609 A1

~87%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: Balaji; Chanda, Bhanu M. Tetrahedron, 1998 , vol. 54, # 43 p. 13237 - 13252

~31%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: Dupont Pharmaceuticals Company Patent: US6187797 B1, 2001 ;

~%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: Swain,C.G. et al. Journal of the American Chemical Society, 1961 , vol. 83, p. 1951 - 1955

~%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: Kim, Hyangmi; Kim, Minjung; Lee, Junghun; Yu, Hana; Hah, Jung-Mi Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 22 p. 6760 - 6767

~%

Ethyl 3-(3-nitrophenyl)-3-oxopropanoate Structure

Ethyl 3-(3-nitr...

CAS#:52119-38-7

Literature: Buelow; Hailer Chemische Berichte, 1902 , vol. 35, p. 928

 Customs

HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

 Synonyms

EINECS 257-670-4
Ethyl 3-(3-nitrophenyl)-3-oxopropanoate
Benzenepropanoic acid, 3-nitro-β-oxo-, ethyl ester
MFCD00126483
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