ChemSpider 2D Image | 4-[3-(Fluoromethyl)-1-azetidinyl]-2-methylpyrimidine | C9H12FN3

4-[3-(Fluoromethyl)-1-azetidinyl]-2-methylpyrimidine

  • Molecular FormulaC9H12FN3
  • Average mass181.210 Da
  • Monoisotopic mass181.101532 Da
  • ChemSpider ID58260928

More details:

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

4-[3-(Fluormethyl)-1-azetidinyl]-2-methylpyrimidin [German] [ACD/IUPAC Name]
4-[3-(Fluoromethyl)-1-azetidinyl]-2-methylpyrimidine [ACD/IUPAC Name]
4-[3-(Fluorométhyl)-1-azétidinyl]-2-méthylpyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 4-[3-(fluoromethyl)-1-azetidinyl]-2-methyl- [ACD/Index Name]
4-(3-(fluoromethyl)azetidin-1-yl)-2-methylpyrimidine
4-[3-(FLUOROMETHYL)AZETIDIN-1-YL]-2-METHYLPYRIMIDINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 284.4±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.3±3.0 kJ/mol
Flash Point: 125.8±19.0 °C
Index of Refraction: 1.526
Molar Refractivity: 47.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.44
ACD/LogD (pH 5.5): -0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.63
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.70
ACD/KOC (pH 7.4): 47.21
Polar Surface Area: 29 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 155.5±3.0 cm3

Click to predict properties on the Chemicalize site


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