ChemSpider 2D Image | 1-N-Allyl-3-phenyl-2,3,4,5-terahydro-benzo(D)azepine | C19H21N

1-N-Allyl-3-phenyl-2,3,4,5-terahydro-benzo(D)azepine

  • Molecular FormulaC19H21N
  • Average mass263.377 Da
  • Monoisotopic mass263.167389 Da
  • ChemSpider ID21111952

More details:

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

1H-3-Benzazepine, 2,3,4,5-tetrahydro-1-phenyl-3-(2-propen-1-yl)- [ACD/Index Name]
1-N-Allyl-3-phenyl-2,3,4,5-terahydro-benzo(D)azepine
1-phenyl-3-(prop-2-en-1-yl)-2,3,4,5-tetrahydro-1H-3-benzazepine
3-Allyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepin [German] [ACD/IUPAC Name]
3-Allyl-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine [ACD/IUPAC Name]
3-Allyl-1-phényl-2,3,4,5-tétrahydro-1H-3-benzazépine [French] [ACD/IUPAC Name]
1-N-ALLYL-3-PHENYL-2,3,4,5-TERAHYDRO-BENZO[D]AZEPINE
1-N-ALLYL-3-PHENYL-2,3,4,5-TETRAHYDRO-BENZO(D)AZEPINE
1-PHENYL-3-(PROP-2-EN-1-YL)-1,2,4,5-TETRAHYDRO-3-BENZAZEPINE
20361-31-3 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.0±0.1 g/cm3
Boiling Point: 382.8±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 166.3±16.2 °C
Index of Refraction: 1.570
Molar Refractivity: 84.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 5.51
ACD/KOC (pH 5.5): 21.82
ACD/LogD (pH 7.4): 3.78
ACD/BCF (pH 7.4): 268.70
ACD/KOC (pH 7.4): 1064.24
Polar Surface Area: 3 Å2
Polarizability: 33.6±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 258.4±3.0 cm3

Click to predict properties on the Chemicalize site


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