Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester

Modify Date: 2025-08-25 09:56:10

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure
Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester structure
Common Name Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester
CAS Number 784-98-5 Molecular Weight 237.20900
Density 1.287g/cm3 Boiling Point 365.5ºC at 760 mmHg
Molecular Formula C11H11NO5 Melting Point N/A
MSDS N/A Flash Point 163.3ºC

 Names

Name ethyl 3-(2-nitrophenyl)-2-oxopropanoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.287g/cm3
Boiling Point 365.5ºC at 760 mmHg
Molecular Formula C11H11NO5
Molecular Weight 237.20900
Flash Point 163.3ºC
Exact Mass 237.06400
PSA 89.19000
LogP 1.79270
Index of Refraction 1.542
InChIKey AKWXORMMOJRIBI-UHFFFAOYSA-N
SMILES CCOC(=O)C(=O)Cc1ccccc1[N+](=O)[O-]

 Synthetic Route

~64%

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure

Benzenepropanoi...

CAS#:784-98-5

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Literature: Suzuki; Gyoutoku; Yokoo; Shinba; Sato; Yamada; Murakami Synlett, 2000 , # 8 p. 1196 - 1198

~95%

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure

Benzenepropanoi...

CAS#:784-98-5

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Literature: Szollosi, Gyoergy; Makra, Zsolt; Kovacs, Lenke; Fueloep, Ferenc; Bartok, Mihaly Advanced Synthesis and Catalysis, 2013 , vol. 355, # 8 p. 1623 - 1629

~%

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure

Benzenepropanoi...

CAS#:784-98-5

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Literature: Bergman, Jan; Sand, Peter Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1985 , p. 93 - 96

~%

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure

Benzenepropanoi...

CAS#:784-98-5

Learn More
Literature: Bergman, Jan; Sand, Peter Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1985 , p. 93 - 96

~%

Benzenepropanoic acid,2-nitro-a-oxo-, ethyl ester Structure

Benzenepropanoi...

CAS#:784-98-5

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Literature: Wislicenus; Thoma Justus Liebigs Annalen der Chemie, 1924 , vol. 436, p. 49
Detail Learn More
Literature: Wislicenus; Thoma Justus Liebigs Annalen der Chemie, 1924 , vol. 436, p. 49

 Synonyms

EINECS 212-318-9
ethyl 2-nitrophenylpyruvate keto tautomer
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