ChemSpider 2D Image | 1-{4-[3-(Diisobutylamino)-2-hydroxypropoxy]-3-methoxyphenyl}ethanone | C20H33NO4

1-{4-[3-(Diisobutylamino)-2-hydroxypropoxy]-3-methoxyphenyl}ethanone

  • Molecular FormulaC20H33NO4
  • Average mass351.480 Da
  • Monoisotopic mass351.240967 Da
  • ChemSpider ID22479946

More details:

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

1-{4-[3-(Diisobutylamino)-2-hydroxypropoxy]-3-methoxyphenyl}ethanon [German] [ACD/IUPAC Name]
1-{4-[3-(Diisobutylamino)-2-hydroxypropoxy]-3-methoxyphenyl}ethanone [ACD/IUPAC Name]
1-{4-[3-(Diisobutylamino)-2-hydroxypropoxy]-3-méthoxyphényl}éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[3-[bis(2-methylpropyl)amino]-2-hydroxypropoxy]-3-methoxyphenyl]- [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: 479.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 244.0±28.7 °C
Index of Refraction: 1.507
Molar Refractivity: 101.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.75
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 14.96
ACD/KOC (pH 7.4): 118.76
Polar Surface Area: 59 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 339.9±3.0 cm3

Click to predict properties on the Chemicalize site


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