Found 1 result

Search term: MF = 'C_{2}HD_{3}N_{4}'

ChemSpider 2D Image | (1-~2~H)-1H-1,2,4-Triazol-3-(~2~H_2_)amine | C2HD3N4

(1-2H)-1H-1,2,4-Triazol-3-(2H2)amine

  • Molecular FormulaC2HD3N4
  • Average mass87.098 Da
  • Monoisotopic mass87.062424 Da
  • ChemSpider ID95629318
  • Non-standard isotope - Non-standard isotope


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(1-2H)-1H-1,2,4-Triazol-3-(2H2)amin [German] [ACD/IUPAC Name]
(1-2H)-1H-1,2,4-Triazol-3-(2H2)amine [ACD/IUPAC Name]
(1-2H)-1H-1,2,4-Triazol-3-(2H2)amine [French] [ACD/IUPAC Name]
1H-1,2,4-Triazol-1-d-3-amine-d2 [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 347.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.2±3.0 kJ/mol
Flash Point: 190.7±10.4 °C
Index of Refraction: 1.670
Molar Refractivity: 21.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.87
ACD/LogD (pH 5.5): -0.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.55
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.50
Polar Surface Area: 68 Å2
Polarizability: 8.4±0.5 10-24cm3
Surface Tension: 105.5±3.0 dyne/cm
Molar Volume: 56.5±3.0 cm3

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