ChemSpider 2D Image | 1-{4-[(Dimethylamino)methyl]cyclohexyl}-3-{[1-(methoxymethyl)cyclobutyl]methyl}urea | C17H33N3O2

1-{4-[(Dimethylamino)methyl]cyclohexyl}-3-{[1-(methoxymethyl)cyclobutyl]methyl}urea

  • Molecular FormulaC17H33N3O2
  • Average mass311.463 Da
  • Monoisotopic mass311.257263 Da
  • ChemSpider ID35204466

More details:

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

1-{4-[(Dimethylamino)methyl]cyclohexyl}-3-{[1-(methoxymethyl)cyclobutyl]methyl}harnstoff [German] [ACD/IUPAC Name]
1-{4-[(Dimethylamino)methyl]cyclohexyl}-3-{[1-(methoxymethyl)cyclobutyl]methyl}urea [ACD/IUPAC Name]
1-{4-[(Diméthylamino)méthyl]cyclohexyl}-3-{[1-(méthoxyméthyl)cyclobutyl]méthyl}urée [French] [ACD/IUPAC Name]
Urea, N-[4-[(dimethylamino)methyl]cyclohexyl]-N'-[[1-(methoxymethyl)cyclobutyl]methyl]- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 456.7±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.7±3.0 kJ/mol
Flash Point: 230.0±21.2 °C
Index of Refraction: 1.515
Molar Refractivity: 89.7±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.25
ACD/LogD (pH 5.5): -1.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.24
Polar Surface Area: 54 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 40.9±5.0 dyne/cm
Molar Volume: 297.5±5.0 cm3

Click to predict properties on the Chemicalize site


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