ChemSpider 2D Image | 4-[(1E)-3-Methyl-1,3-butadien-1-yl]-1H-indole-3-carbaldehyde | C14H13NO

4-[(1E)-3-Methyl-1,3-butadien-1-yl]-1H-indole-3-carbaldehyde

  • Molecular FormulaC14H13NO
  • Average mass211.259 Da
  • Monoisotopic mass211.099716 Da
  • ChemSpider ID28533913

  • Double-bond stereo - Double-bond stereo

More details:

Featured data source
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Indole-3-carboxaldehyde, 4-[(1E)-3-methyl-1,3-butadien-1-yl]- [ACD/Index Name]
4-[(1E)-3-Methyl-1,3-butadien-1-yl]-1H-indol-3-carbaldehyd [German] [ACD/IUPAC Name]
4-[(1E)-3-Methyl-1,3-butadien-1-yl]-1H-indole-3-carbaldehyde [ACD/IUPAC Name]
4-[(1E)-3-Méthyl-1,3-butadién-1-yl]-1H-indole-3-carbaldéhyde [French] [ACD/IUPAC Name]
indiacen A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 419.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.3±3.0 kJ/mol
Flash Point: 213.3±30.6 °C
Index of Refraction: 1.694
Molar Refractivity: 70.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 132.82
ACD/KOC (pH 5.5): 1151.98
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 132.82
ACD/KOC (pH 7.4): 1151.98
Polar Surface Area: 33 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 182.4±3.0 cm3

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