ChemSpider 2D Image | 1-{3-Fluoro-4-[isopropyl(methyl)amino]phenyl}-3-(3-hydroxypropyl)urea | C14H22FN3O2

1-{3-Fluoro-4-[isopropyl(methyl)amino]phenyl}-3-(3-hydroxypropyl)urea

  • Molecular FormulaC14H22FN3O2
  • Average mass283.342 Da
  • Monoisotopic mass283.169617 Da
  • ChemSpider ID31723790

More details:

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

1-{3-Fluor-4-[isopropyl(methyl)amino]phenyl}-3-(3-hydroxypropyl)harnstoff [German] [ACD/IUPAC Name]
1-{3-Fluoro-4-[isopropyl(methyl)amino]phenyl}-3-(3-hydroxypropyl)urea [ACD/IUPAC Name]
1-{3-Fluoro-4-[isopropyl(méthyl)amino]phényl}-3-(3-hydroxypropyl)urée [French] [ACD/IUPAC Name]
Urea, N-[3-fluoro-4-[methyl(1-methylethyl)amino]phenyl]-N'-(3-hydroxypropyl)- [ACD/Index Name]
1-{3-FLUORO-4-[METHYL(PROPAN-2-YL)AMINO]PHENYL}-3-(3-HYDROXYPROPYL)UREA

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

Density: 1.2±0.1 g/cm3
Boiling Point: 409.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 201.2±28.7 °C
Index of Refraction: 1.575
Molar Refractivity: 78.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 0.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.83
ACD/LogD (pH 7.4): 1.78
ACD/BCF (pH 7.4): 10.28
ACD/KOC (pH 7.4): 136.58
Polar Surface Area: 65 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 237.4±3.0 cm3

Click to predict properties on the Chemicalize site


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