ChemSpider 2D Image | 1-(3-Chloro-1,2,4-oxadiazol-5-yl)methanamine | C3H4ClN3O

1-(3-Chloro-1,2,4-oxadiazol-5-yl)methanamine

  • Molecular FormulaC3H4ClN3O
  • Average mass133.536 Da
  • Monoisotopic mass133.004288 Da
  • ChemSpider ID45532298

More details:

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

1-(3-Chlor-1,2,4-oxadiazol-5-yl)methanamin [German] [ACD/IUPAC Name]
1-(3-Chloro-1,2,4-oxadiazol-5-yl)methanamine [ACD/IUPAC Name]
1-(3-Chloro-1,2,4-oxadiazol-5-yl)méthanamine [French] [ACD/IUPAC Name]
1,2,4-Oxadiazole-5-methanamine, 3-chloro- [ACD/Index Name]
1782433-42-4 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 251.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.8±3.0 kJ/mol
Flash Point: 105.7±27.9 °C
Index of Refraction: 1.532
Molar Refractivity: 28.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.04
ACD/LogD (pH 5.5): -0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.02
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.52
Polar Surface Area: 65 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 59.1±3.0 dyne/cm
Molar Volume: 90.6±3.0 cm3

Click to predict properties on the Chemicalize site


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