Product Name

  • Name

    Ethyl 2-bromo-3-nitrobenzoate

  • EINECS
  • CAS No. 31706-23-7
  • Article Data4
  • CAS DataBase
  • Density 1.594 g/cm3
  • Solubility
  • Melting Point 38 °C
  • Formula C9H8BrNO4
  • Boiling Point 314.5 °C at 760 mmHg
  • Molecular Weight 274.07
  • Flash Point 144 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 31706-23-7 (Ethyl 2-bromo-3-nitrobenzoate)
  • Hazard Symbols
  • Synonyms 2-Bromo-3-nitrobenzoic acid ethyl ester;
  • PSA 72.12000
  • LogP 3.05720

Ethyl 2-bromo-3-nitrobenzoate Chemical Properties

Molecular Structure of Ethyl 2-bromo-3-nitrobenzoate (CAS No.31706-23-7):

Molecular Formula: C9H8BrNO4
Molecular Weight: 274.07
IUPAC Name: Ethyl 2-bromo-3-nitrobenzoate 
CAS No: 31706-23-7
H bond acceptors: 5
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 72.12 Å2
Index of Refraction: 1.576
Molar Refractivity: 56.89 cm3
Molar Volume: 171.8 cm3
Surface Tension: 50.3 dyne/cm
Density: 1.594 g/cm3
Flash Point: 144 °C
Enthalpy of Vaporization: 55.57 kJ/mol
Boiling Point: 314.5 °C at 760 mmHg
Vapour Pressure of Ethyl 2-bromo-3-nitrobenzoate (CAS No.31706-23-7): 0.000463 mmHg at 25°C
Canonical SMILES: CCOC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])Br
InChI: InChI=1S/C9H8BrNO4/c1-2-15-9(12)6-4-3-5-7(8(6)10)11(13)14/h3-5H,2H2,1H3
InChIKey: WTNZOABLVURCTP-UHFFFAOYSA-N

Ethyl 2-bromo-3-nitrobenzoate Specification

  Ethyl 2-bromo-3-nitrobenzoate (CAS No.31706-23-7), it also can be called 2-Bromo-3-nitrobenzoic acid ethyl ester ; Benzoic acid, 2-bromo-3-nitro-, ethyl ester .

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