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Search term: MF = 'C_{12}H_{16}F_{2}N_{2}O'

ChemSpider 2D Image | 1-[1-(3,4-Difluorophenyl)ethyl]-3-isopropylurea | C12H16F2N2O

1-[1-(3,4-Difluorophenyl)ethyl]-3-isopropylurea

  • Molecular FormulaC12H16F2N2O
  • Average mass242.265 Da
  • Monoisotopic mass242.123077 Da
  • ChemSpider ID22380027

More details:






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

1-[1-(3,4-Difluorophenyl)ethyl]-3-isopropylurea [ACD/IUPAC Name]
1-[1-(3,4-Difluorophényl)éthyl]-3-isopropylurée [French] [ACD/IUPAC Name]
1-[1-(3,4-Difluorphenyl)ethyl]-3-isopropylharnstoff [German] [ACD/IUPAC Name]
Urea, N-[1-(3,4-difluorophenyl)ethyl]-N'-(1-methylethyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 376.1±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 181.3±25.1 °C
Index of Refraction: 1.490
Molar Refractivity: 61.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.73
ACD/KOC (pH 5.5): 431.93
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.73
ACD/KOC (pH 7.4): 431.92
Polar Surface Area: 41 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 212.6±3.0 cm3

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