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	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

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

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-]

2-Nitrotoluene

CAS#:88-72-2

Diethyloxalate

CAS#:95-92-1

~64%

Benzenepropanoi...

CAS#:784-98-5

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

Ethanol

CAS#:64-17-5

2-Nitrophenylpy...

CAS#:5461-32-5

~95%

Benzenepropanoi...

CAS#:784-98-5

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

2-Nitrotoluene

CAS#:88-72-2

Benzenepropanoi...

CAS#:784-98-5

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

N/A

CAS#:96497-89-1

Benzenepropanoi...

CAS#:784-98-5

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

Ethanol

CAS#:64-17-5

(2-nitro-phenyl...

CAS#:610-33-3

Benzenepropanoi...

CAS#:784-98-5

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

Diethyl ether

CAS#:60-29-7

Ethanol

CAS#:64-17-5

2-Nitrotoluene

CAS#:88-72-2

Potassium ethoxide

CAS#:917-58-8

Diethyloxalate

CAS#:95-92-1

Detail

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

Precursor 7
CAS#:88-72-2 2-Nitrotoluene CAS#:95-92-1 Diethyloxalate CAS#:64-17-5 Ethanol CAS#:5461-32-5 2-Nitrophenylpy...
CAS#:610-33-3 (2-nitro-phenyl... CAS#:60-29-7 Diethyl ether CAS#:917-58-8 Potassium ethoxide
DownStream 8
CAS#:5461-32-5 2-Nitrophenylpy... CAS#:7664-93-9 Sulfuric acid CAS#:3770-50-1 Ethyl indole-2-... CAS#:301155-96-4 3-hydroxy-3,4-d...
CAS#:41969-23-7 ethyl 1-hydroxy... CAS#:1477-50-5 Indole-2-carbox... CAS#:24621-70-3 1H-Indole-2-methanol CAS#:88599-83-1 ethyl 2-acetylo...