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Basic Information
CAS No.: 953-26-4
Name: Ethyl 4-nitrocinnamate
Article Data: 90
Molecular Structure:
Molecular Structure of 953-26-4 (Ethyl 4-nitrocinnamate)
Formula: C11H11NO4
Molecular Weight: 221.213
Synonyms: Cinnamicacid, p-nitro-, ethyl ester (6CI,7CI,8CI);3-(4-Nitrophenyl)-2-propenoic acidethyl ester;3-(4-Nitrophenyl)acrylic acid ethyl ester;Ethyl p-nitrocinnamate;NSC 4697;NSC 636709;
EINECS: 213-463-0
Density: 1.237 g/cm3
Melting Point: 138-140 °C(lit.)
Boiling Point: 326.582 °C at 760 mmHg
Flash Point: 141.05 °C
Solubility: insoluble in water
Appearance: light yellow-beige to yellow fine cryst. powder
Safety: 24/25
PSA: 72.12000
LogP: 2.69430
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Chemistry

Molecular structure of 2-Propenoic acid, 3-(4-nitrophenyl)-, ethyl ester (CAS NO.953-26-4) is:

Product Name: 2-Propenoic acid, 3-(4-nitrophenyl)-, ethyl ester
CAS Registry Number: 953-26-4
IUPAC Name: ethyl (E)-3-(4-nitrophenyl)prop-2-enoate
Molecular Weight: 221.20934 [g/mol]
Molecular Formula: C11H11NO4
XLogP3: 2.8
H-Bond Donor: 0
H-Bond Acceptor: 4
EINECS: 213-463-0
Melting Point: 138-140 °C(lit.)
Water Solubility: insoluble 
urface Tension: 47.8 dyne/cm
Density: 1.237 g/cm3
Flash Point: 141 °C
Enthalpy of Vaporization: 56.88 kJ/mol
Boiling Point: 326.6 °C at 760 mmHg
Vapour Pressure: 0.000214 mmHg at 25°C
Product Categories: Aromatic Cinnamic Acids, Esters and Derivatives; Cinnamic acid; C10 to C11; Carbonyl Compounds; Esters

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 500mg/kg (500mg/kg)   "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 6, Pg. 215, 1954.

Safety Profile

Safety Statements: 24/25 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
RTECS: GE0353332
HS Code: 29163900

Specification

 2-Propenoic acid, 3-(4-nitrophenyl)-, ethyl ester , its cas register number is 953-26-4. It also can be called 1-09-00-00247 (Beilstein Handbook Reference) ; AI3-19857 ; BRN 2052533 ; Cinnamic acid, p-nitro-, ethyl ester ; Ethyl 4-nitrocinnamate ; Ethyl p-nitrocinnamate ; NSC 4697 ; Propenoic acid, 3-(4-nitrophenyl)-, ethyl ester  . It is a light yellow-beige to yellow fine cryst. powder.