ChemSpider 2D Image | 2-(3-Isopropyl-1H-1,2,4-triazol-5-yl)-4-[3-(methylsulfonyl)propyl]morpholine | C13H24N4O3S

2-(3-Isopropyl-1H-1,2,4-triazol-5-yl)-4-[3-(methylsulfonyl)propyl]morpholine

  • Molecular FormulaC13H24N4O3S
  • Average mass316.420 Da
  • Monoisotopic mass316.156921 Da
  • ChemSpider ID30250641

More details:

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

2-(3-Isopropyl-1H-1,2,4-triazol-5-yl)-4-[3-(methylsulfonyl)propyl]morpholin [German] [ACD/IUPAC Name]
2-(3-Isopropyl-1H-1,2,4-triazol-5-yl)-4-[3-(methylsulfonyl)propyl]morpholine [ACD/IUPAC Name]
2-(3-Isopropyl-1H-1,2,4-triazol-5-yl)-4-[3-(méthylsulfonyl)propyl]morpholine [French] [ACD/IUPAC Name]
Morpholine, 2-[3-(1-methylethyl)-1H-1,2,4-triazol-5-yl]-4-[3-(methylsulfonyl)propyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 576.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.2±32.9 °C
Index of Refraction: 1.526
Molar Refractivity: 79.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.67
ACD/LogD (pH 5.5): -1.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.99
ACD/LogD (pH 7.4): -0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 21.75
Polar Surface Area: 97 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 259.2±3.0 cm3

Click to predict properties on the Chemicalize site


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