ChemSpider 2D Image | 4-{[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino}pentyl butylcarbamate | C18H30N2O5

4-{[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino}pentyl butylcarbamate

  • Molecular FormulaC18H30N2O5
  • Average mass354.441 Da
  • Monoisotopic mass354.215485 Da
  • ChemSpider ID25040849

More details:

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

4-{[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino}pentyl butylcarbamate [ACD/IUPAC Name]
4-{[2-(3,4-Dihydroxyphenyl)-2-hydroxyethyl]amino}pentyl-butylcarbamat [German] [ACD/IUPAC Name]
Butylcarbamate de 4-{[2-(3,4-dihydroxyphényl)-2-hydroxyéthyl]amino}pentyle [French] [ACD/IUPAC Name]
Carbamic acid, N-butyl-, 4-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]pentyl ester [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 573.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 300.6±30.1 °C
Index of Refraction: 1.547
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 1.81
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.77
Polar Surface Area: 111 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 303.9±3.0 cm3

Click to predict properties on the Chemicalize site


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