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39562-16-8

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Basic Information
CAS No.: 39562-16-8
Name: ETHYL 2-ACETYL-3-(3-NITROPHENYL)PROPENOATE
Article Data: 23
Molecular Structure:
Molecular Structure of 39562-16-8 (ETHYL 2-ACETYL-3-(3-NITROPHENYL)PROPENOATE)
Formula: C13H13NO5
Molecular Weight: 263.25
Synonyms: ETHYL 3-NITROBENZYLIDENEACETOACETATE;ETHYL 2-(3-NITROBENZYLIDENE)ACETOACETATE;3-NITROBENZYLIDENE ETHYL ESTER;BUTENOIC ACID, 2-((3-NITROPHENYL)METHYLENE)-3-OXO-, ETHYL ESTER;CINNAMIC ACID, α-ACETYL-m-NITRO-, ETHYL ESTER;ETHYL α-ACETYL-β-(m-NITROPHENYL)ACRYLATE;Ethyl 2-(m-nitrobenzylidene)acetoacetate;
EINECS: 404-490-0
Density: 1.261g/cm3
Melting Point: 160℃ (ethanol )
Boiling Point: 399.2°C at 760 mmHg
Flash Point: 171.3°C
Hazard Symbols: Moderately toxic by ingestion, inhalation, and skin contact.
Risk Codes: 41-43-52/53
Safety: Moderately toxic by ingestion, inhalation, and skin contact. When heated to decomposition it emits toxic vapors of NOx.
PSA: 89.19000
LogP: 2.65350
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Chemistry

Product Name: Ethyl 2-(m-nitrobenzylidene)-acetoacetate
Synonyms of Ethyl 2-(m-nitrobenzylidene)-acetoacetate (CAS NO.39562-16-8 ): Ethyl 2-acetyl-3-(3-nitrophenyl)propenoate ; 3-nitrobenzylideneethylester ; butanoic acid, 2-[(3-nitrophenyl)methylene]-3-oxo, ethyl ester ; ethyl -aceto-(m-nitrobenzylidene)acetate;ethyl (e)-2-(3-nitrobenzylidene)-3-oxobutanoate
CAS NO:39562-16-8 
Molecular Formula: C13H13NO5                
Molecular Weight: 263.246                      
Index of Refraction:  1.574 
Surface Tension:  48.5 dyne/cm 
Density:  1.261 g/cm3 
Flash Point:  171.3 °C 
Enthalpy of Vaporization:  64.98 kJ/mol 
Boiling Point:  399.2 °C at 760 mmHg 
Vapour Pressure:  1.4E-06 mmHg at 25°C 
Molecular Structure:
 

Uses

 Ethyl 2-(m-nitrobenzylidene)-acetoacetate (CAS NO.39562-16-8 ) can make Nitrendipine intermediates.

Toxicity Data With Reference

1.    

orl-rat LDLo:2 g/kg

     IJTOFN    International Journal of Toxicology. 19 (2000),331.
2.    

ihl-rat LC50:>4857 mg/m3/4H

     IJTOFN    International Journal of Toxicology. 19 (2000),331.
3.    

skn-rat LD50:>2 g/kg

     IJTOFN    International Journal of Toxicology. 19 (2000),331.

Safety Profile

Hazard Codes: Xi IrritantXi
Risk Statements: 41-43-52/53 
R41: Risk of serious damage to the eyes. R43: May cause sensitization by skin contact. R52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 24-26-37/39-61 
S24: Avoid contact with skin. S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S37/39: Wear suitable gloves and eye/face protection. S61: Avoid release to the environment. Refer to special instructions / safety data sheets.
Moderately toxic by ingestion, inhalation, and skin contact. When heated to decomposition it emits toxic vapors of NOx.