ChemSpider 2D Image | Methyl (3,5-dichloro-1,2,4-triazolidin-1-yl)acetate | C5H9Cl2N3O2

Methyl (3,5-dichloro-1,2,4-triazolidin-1-yl)acetate

  • Molecular FormulaC5H9Cl2N3O2
  • Average mass214.050 Da
  • Monoisotopic mass213.007187 Da
  • ChemSpider ID109652764

More details:

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

(3,5-Dichloro-1,2,4-triazolidin-1-yl)acétate de méthyle [French] [ACD/IUPAC Name]
1,2,4-Triazolidine-1-acetic acid, 3,5-dichloro-, methyl ester [ACD/Index Name]
Methyl (3,5-dichloro-1,2,4-triazolidin-1-yl)acetate [ACD/IUPAC Name]
Methyl-(3,5-dichlor-1,2,4-triazolidin-1-yl)acetat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 290.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 129.6±30.1 °C
Index of Refraction: 1.554
Molar Refractivity: 45.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.79
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.35
ACD/LogD (pH 7.4): -0.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.35
Polar Surface Area: 54 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 51.3±5.0 dyne/cm
Molar Volume: 143.0±5.0 cm3

Click to predict properties on the Chemicalize site


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