ChemSpider 2D Image | (3aR,7aS)-Hexahydro-1H-isoindole-1,3(2H)-dione | C8H11NO2

(3aR,7aS)-Hexahydro-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC8H11NO2
  • Average mass153.178 Da
  • Monoisotopic mass153.078979 Da
  • ChemSpider ID26635170

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(3aR,7aS)-Hexahydro-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
(3aR,7aS)-Hexahydro-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
(3aR,7aS)-Hexahydro-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
1H-Isoindole-1,3(2H)-dione, hexahydro-, (3aR,7aS)- [ACD/Index Name]
(3aS)-Hexahydro-1H-isoindole-1,3(2H)-dione
1,2-Cyclohexanedicarboximide
1002359-81-0 [RN]
117307-09-2 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 330.8±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.3±3.0 kJ/mol
Flash Point: 159.3±19.4 °C
Index of Refraction: 1.506
Molar Refractivity: 38.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.36
ACD/LogD (pH 5.5): 0.71
ACD/BCF (pH 5.5): 2.06
ACD/KOC (pH 5.5): 58.34
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 2.06
ACD/KOC (pH 7.4): 58.34
Polar Surface Area: 46 Å2
Polarizability: 15.3±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 129.7±3.0 cm3

Click to predict properties on the Chemicalize site


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