Found 63 results

Search term: MF = 'C_{21}H_{13}NO_{2}'
ChemSpider 2D Image | 2-[3-(1-Naphthyl)-2-propyn-1-yl]-1H-isoindole-1,3(2H)-dione | C21H13NO2

2-[3-(1-Naphthyl)-2-propyn-1-yl]-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC21H13NO2
  • Average mass311.333 Da
  • Monoisotopic mass311.094635 Da
  • ChemSpider ID28569751

More details:

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

1H-Isoindole-1,3(2H)-dione, 2-[3-(1-naphthalenyl)-2-propyn-1-yl]- [ACD/Index Name]
2-[3-(1-Naphthyl)-2-propin-1-yl]-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-[3-(1-Naphthyl)-2-propyn-1-yl]-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-[3-(1-Naphtyl)-2-propyn-1-yl]-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
2-[3-(Naphthalen-1-yl)prop-2-yn-1-yl]-1H-isoindole-1,3(2H)-dione
922190-47-4 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 514.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 239.5±17.7 °C
Index of Refraction: 1.735
Molar Refractivity: 92.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.83
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3407.77
ACD/KOC (pH 5.5): 11752.68
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3407.77
ACD/KOC (pH 7.4): 11752.68
Polar Surface Area: 37 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 70.0±5.0 dyne/cm
Molar Volume: 230.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement