Product Name

  • Name

    N,N-DIETHYL-N′-(2-(2-ETHYL-1,3-BENZODIOX-OL-2-YL)ETHYL) ETHYLENEDIAMINE DIMALEATE

  • EINECS
  • CAS No. 52400-60-9
  • Density g/cm3
  • Solubility
  • Melting Point
  • Formula C17H28N2O2•2C4H4O4
  • Boiling Point 376.8°Cat760mmHg
  • Molecular Weight 524.63
  • Flash Point 181.7°C
  • Transport Information
  • Appearance
  • Safety Poison by intravenous and intraperitoneal routes. When heated to decomposition it emits toxic fumes of NOx.
  • Risk Codes
  • Molecular Structure Molecular Structure of 52400-60-9 (N,N-DIETHYL-N′-(2-(2-ETHYL-1,3-BENZODIOX-OL-2-YL)ETHYL) ETHYLENEDIAMINE DIMALEATE			)
  • Hazard Symbols
  • Synonyms
  • PSA
  • LogP

N,N-Diethyl-n'-(2-(2-ethyl-1,3-benzodiox-ol-2-yl)ethyl) ethylenediamine dimaleate Chemical Properties

IUPAC Name: Diethyl-[2-[2-(2-ethyl-1,3-benzodioxol-2-yl)ethylazaniumyl]ethyl]azanium ; (Z)-4-hydroxy-4-oxobut-2-enoate
Synonyms of N,N-Diethyl-n'-(2-(2-ethyl-1,3-benzodiox-ol-2-yl)ethyl) ethylenediamine dimaleate (CAS NO.52400-60-9): 1,3-Benzodioxole, 2-(2-(2-(diethylamino)ethylamino)ethyl)-2-ethyl-, dimaleate
InChI: InChI=1/C17H28N2O2.2C4H4O4/c1-4-17(11-12-18-13-14-19(5-2)6-3)20-15-9-7-8-10-16(15)21-17;2*5-3(6)1-2-4(7)8/h7-10,18H,4-6,11-14H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
InChIKey: IKPHHYCFKRWSLZ-SPIKMXEPBG
Std. InChI: InChI=1S/C17H28N2O2.2C4H4O4/c1-4-17(11-12-18-13-14-19(5-2)6-3)20-15-9-7-8-10-16(15)21-17;2*5-3(6)1-2-4(7)8/h7-10,18H,4-6,11-14H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
Std. InChIKey: IKPHHYCFKRWSLZ-SPIKMXEPSA-N
CAS NO: 52400-60-9
Molecular Formula: C25H36N2O10
Molecular Weight: 524.5607
Molecular Structure :
H bond acceptors: 4
H bond donors: 1
Freely Rotating Bonds: 9
Polar Surface Area: 18.46 Å2
Flash Point: 181.7 °C
Enthalpy of Vaporization: 62.45 kJ/mol
Boiling Point: 376.8 °C at 760 mmHg
Vapour Pressure: 7.04E-06 mmHg at 25°C

N,N-Diethyl-n'-(2-(2-ethyl-1,3-benzodiox-ol-2-yl)ethyl) ethylenediamine dimaleate Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.
rat LD50 intravenous 55mg/kg (55mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 12, Pg. 413, 1977.

N,N-Diethyl-n'-(2-(2-ethyl-1,3-benzodiox-ol-2-yl)ethyl) ethylenediamine dimaleate Safety Profile

Poison by intravenous and intraperitoneal routes. When N,N-Diethyl-n'-(2-(2-ethyl-1,3-benzodiox-ol-2-yl)ethyl) ethylenediamine dimaleate (CAS NO.52400-60-9) is heated to decomposition, it emits toxic fumes of NOx.

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