ChemSpider 2D Image | N-{3-Isopropoxy-4-methoxy-2-[(1Z)-1-propen-1-yl]benzyl}-1-phenylmethanesulfonamide | C21H27NO4S

N-{3-Isopropoxy-4-methoxy-2-[(1Z)-1-propen-1-yl]benzyl}-1-phenylmethanesulfonamide

  • Molecular FormulaC21H27NO4S
  • Average mass389.508 Da
  • Monoisotopic mass389.166077 Da
  • ChemSpider ID30654759

  • Double-bond stereo - Double-bond stereo

More details:

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

Benzenemethanesulfonamide, N-[[4-methoxy-3-(1-methylethoxy)-2-[(1Z)-1-propen-1-yl]phenyl]methyl]- [ACD/Index Name]
N-{3-Isopropoxy-4-methoxy-2-[(1Z)-1-propen-1-yl]benzyl}-1-phenylmethanesulfonamide [ACD/IUPAC Name]
N-{3-Isopropoxy-4-méthoxy-2-[(1Z)-1-propén-1-yl]benzyl}-1-phénylméthanesulfonamide [French] [ACD/IUPAC Name]
N-{3-Isopropoxy-4-methoxy-2-[(1Z)-1-propen-1-yl]benzyl}-1-phenylmethansulfonamid [German] [ACD/IUPAC 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: 545.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 283.7±32.9 °C
Index of Refraction: 1.564
Molar Refractivity: 109.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.40
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 398.55
ACD/KOC (pH 5.5): 2529.41
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 396.96
ACD/KOC (pH 7.4): 2519.37
Polar Surface Area: 73 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 335.2±3.0 cm3

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