ChemSpider 2D Image | 4-(4-Chloro-2-pentanyl)-2-methyl-1,2,3-triazolidine | C8H18ClN3

4-(4-Chloro-2-pentanyl)-2-methyl-1,2,3-triazolidine

  • Molecular FormulaC8H18ClN3
  • Average mass191.702 Da
  • Monoisotopic mass191.118927 Da
  • ChemSpider ID109498049

More details:

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

1,2,3-Triazolidine, 4-(3-chloro-1-methylbutyl)-2-methyl- [ACD/Index Name]
4-(4-Chlor-2-pentanyl)-2-methyl-1,2,3-triazolidin [German] [ACD/IUPAC Name]
4-(4-Chloro-2-pentanyl)-2-methyl-1,2,3-triazolidine [ACD/IUPAC Name]
4-(4-Chloro-2-pentanyl)-2-méthyl-1,2,3-triazolidine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 248.3±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.6±3.0 kJ/mol
Flash Point: 104.0±25.1 °C
Index of Refraction: 1.465
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.75
ACD/LogD (pH 5.5): -1.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.02
Polar Surface Area: 27 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 28.6±3.0 dyne/cm
Molar Volume: 188.7±3.0 cm3

Click to predict properties on the Chemicalize site


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