ChemSpider 2D Image | 1-{3-[(Dimethylamino)methyl]-4-fluorobenzyl}-3-(2-methoxyethyl)urea | C14H22FN3O2

1-{3-[(Dimethylamino)methyl]-4-fluorobenzyl}-3-(2-methoxyethyl)urea

  • Molecular FormulaC14H22FN3O2
  • Average mass283.342 Da
  • Monoisotopic mass283.169617 Da
  • ChemSpider ID30477520

More details:

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

1-{3-[(Dimethylamino)methyl]-4-fluorbenzyl}-3-(2-methoxyethyl)harnstoff [German] [ACD/IUPAC Name]
1-{3-[(Dimethylamino)methyl]-4-fluorobenzyl}-3-(2-methoxyethyl)urea [ACD/IUPAC Name]
1-{3-[(Diméthylamino)méthyl]-4-fluorobenzyl}-3-(2-méthoxyéthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[[3-[(dimethylamino)methyl]-4-fluorophenyl]methyl]-N'-(2-methoxyethyl)- [ACD/Index Name]
1-({3-[(DIMETHYLAMINO)METHYL]-4-FLUOROPHENYL}METHYL)-3-(2-METHOXYETHYL)UREA

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

Density: 1.1±0.1 g/cm3
Boiling Point: 437.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.4±3.0 kJ/mol
Flash Point: 218.1±28.7 °C
Index of Refraction: 1.516
Molar Refractivity: 76.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -1.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.28
Polar Surface Area: 54 Å2
Polarizability: 30.4±0.5 10-24cm3
Surface Tension: 38.8±3.0 dyne/cm
Molar Volume: 253.7±3.0 cm3

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