Found 403 results

Search term: MF = 'C_{21}H_{19}N_{3}'
ChemSpider 2D Image | 3-(1-Benzyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole-6-carbonitrile | C21H19N3

3-(1-Benzyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole-6-carbonitrile

  • Molecular FormulaC21H19N3
  • Average mass313.396 Da
  • Monoisotopic mass313.157898 Da
  • ChemSpider ID32689477

More details:

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

181184-09-8 [RN]
1H-Indole-6-carbonitrile, 3-[1,2,3,6-tetrahydro-1-(phenylmethyl)-4-pyridinyl]- [ACD/Index Name]
3-(1-Benzyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indol-6-carbonitril [German] [ACD/IUPAC Name]
3-(1-Benzyl-1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole-6-carbonitrile [ACD/IUPAC Name]
3-(1-Benzyl-1,2,3,6-tétrahydro-4-pyridinyl)-1H-indole-6-carbonitrile [French] [ACD/IUPAC Name]
3-(1-benzyl-1,2,3,6-tetrahydropyridin-4-yl)-1H-indole-6-carbonitrile
3-(1-benzyl-1,2,3,6-tetrahydro-4-pyridyl)-6-cyanoindole
3-(1-Benzyl-1,2,3,6-tetrahydro-4-pyridyl)indole-6-carbonitrile
3-(1-benzyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole-6-carbonitrile
MFCD28126771 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 539.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.7±3.0 kJ/mol
Flash Point: 280.2±30.1 °C
Index of Refraction: 1.695
Molar Refractivity: 96.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 4.18
ACD/KOC (pH 5.5): 21.65
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 209.76
ACD/KOC (pH 7.4): 1087.44
Polar Surface Area: 43 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 63.9±5.0 dyne/cm
Molar Volume: 252.0±5.0 cm3

Click to predict properties on the Chemicalize site


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