Product Name

  • Name

    Ethyl p-nitrobenzoate

  • EINECS 202-786-2
  • CAS No. 99-77-4
  • Article Data248
  • CAS DataBase
  • Density 1.253 g/cm3
  • Solubility insoluble in water
  • Melting Point 55-59 °C(lit.)
  • Formula C9H9NO4
  • Boiling Point 315 °C at 760 mmHg
  • Molecular Weight 195.175
  • Flash Point 148.2 °C
  • Transport Information
  • Appearance yellow crystalline powder
  • Safety 22-24/25
  • Risk Codes 33
  • Molecular Structure Molecular Structure of 99-77-4 (Ethyl p-nitrobenzoate)
  • Hazard Symbols
  • Synonyms Benzoicacid, p-nitro-, ethyl ester (6CI,8CI);4-(Ethoxycarbonyl)nitrobenzene;4-Ethoxycarbonyl-1-nitrobenzene;4-Nitrobenzoic acid ethyl ester;Ethyl4-nitrobenzoate;
  • PSA 72.12000
  • LogP 2.29470

Ethyl p-nitrobenzoate Chemical Properties

Molecular Structure of Ethyl p-nitrobenzoate (CAS NO.99-77-4):

IUPAC Name: ethyl 4-nitrobenzoate 
Empirical Formula: C9H9NO4
Molecular Weight: 195.1721
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 72.12 Å2
Index of Refraction: 1.544
Molar Refractivity: 49.2 cm3
Molar Volume: 155.6 cm3
Surface Tension: 46.9 dyne/cm
Density: 1.253 g/cm3
Flash Point: 148.2 °C
Enthalpy of Vaporization: 55.62 kJ/mol
Boiling Point: 315 °C at 760 mmHg
Vapour Pressure: 0.00045 mmHg at 25°C
EINECS: 202-786-2
Melting Point: 55-59 °C(lit.)
Form: yellow crystalline powder
Merck: 14,3832
BRN: 1912879
Product Categories: Fine chemical & intermediates; Aromatic Esters; C8 to C9; Carbonyl Compounds; Esters

Ethyl p-nitrobenzoate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   National Technical Information Service. Vol. AD691-490,
mouse LD50 oral 2050mg/kg (2050mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Toksikologicheskii Vestnik. Vol. (6), Pg. 29, 1997.
rat LD50 oral 2660mg/kg (2660mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Toksikologicheskii Vestnik. Vol. (6), Pg. 29, 1997.

Ethyl p-nitrobenzoate Consensus Reports

Reported in EPA TSCA Inventory.

Ethyl p-nitrobenzoate Safety Profile

Poison by intraperitoneal route. An insecticide. See also Nitro compounds of aromatic hydrocarbons.
Safety information of Ethyl p-nitrobenzoate (CAS NO.99-77-4):
Risk Statements: 33
R33:Danger of cumulative effects.
Safety Statements: 22-24/25
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
RTECS: DH5600000

Ethyl p-nitrobenzoate Specification

  Ethyl p-nitrobenzoate , with CAS number of 99-77-4, can be called Ethyl4-nitrobenzoate ; 4-Nitrobenzoic acid ethyl ester ; 4-Ethoxycarbonyl-1-nitrobenzene ; 4-(Ethoxycarbonyl)nitrobenzene . Ethyl p-nitrobenzoate (CAS NO.99-77-4) is used as intermediates in organic synthesis. In the pharmaceutical industry for the production of local anesthetic benzocaine, tetracaine hydrochloride and retirement cough and other antitussives.

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