ChemSpider 2D Image | (8S)-8-(Dipropylamino)-6,7,8,9-tetrahydro-3H-benzo[e]indole-2-carbonitrile | C19H25N3

(8S)-8-(Dipropylamino)-6,7,8,9-tetrahydro-3H-benzo[e]indole-2-carbonitrile

  • Molecular FormulaC19H25N3
  • Average mass295.422 Da
  • Monoisotopic mass295.204834 Da
  • ChemSpider ID26353988

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(8S)-8-(Dipropylamino)-6,7,8,9-tetrahydro-3H-benzo[e]indol-2-carbonitril [German] [ACD/IUPAC Name]
(8S)-8-(Dipropylamino)-6,7,8,9-tetrahydro-3H-benzo[e]indole-2-carbonitrile [ACD/IUPAC Name]
(8S)-8-(Dipropylamino)-6,7,8,9-tétrahydro-3H-benzo[e]indole-2-carbonitrile [French] [ACD/IUPAC Name]
3H-Benz[e]indole-2-carbonitrile, 8-(dipropylamino)-6,7,8,9-tetrahydro-, (8S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 491.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 251.0±28.7 °C
Index of Refraction: 1.603
Molar Refractivity: 90.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.49
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 1.38
ACD/KOC (pH 5.5): 5.99
ACD/LogD (pH 7.4): 2.47
ACD/BCF (pH 7.4): 14.52
ACD/KOC (pH 7.4): 62.90
Polar Surface Area: 43 Å2
Polarizability: 36.0±0.5 10-24cm3
Surface Tension: 52.1±5.0 dyne/cm
Molar Volume: 264.7±5.0 cm3

Click to predict properties on the Chemicalize site


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