ChemSpider 2D Image | 1,3,6,6-Tetramethyl-6,7-dihydro-8(5H)-isoquinolinone | C13H17NO

1,3,6,6-Tetramethyl-6,7-dihydro-8(5H)-isoquinolinone

  • Molecular FormulaC13H17NO
  • Average mass203.280 Da
  • Monoisotopic mass203.131012 Da
  • ChemSpider ID32681558

More details:

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

1,3,6,6-Tetramethyl-6,7-dihydro-8(5H)-isochinolinon [German] [ACD/IUPAC Name]
1,3,6,6-Tétraméthyl-6,7-dihydro-8(5H)-isoquinoléinone [French] [ACD/IUPAC Name]
1,3,6,6-Tetramethyl-6,7-dihydro-8(5H)-isoquinolinone [ACD/IUPAC Name]
8(5H)-Isoquinolinone, 6,7-dihydro-1,3,6,6-tetramethyl- [ACD/Index Name]
1,3,6,6-Tetramethyl-6,7-dihydroisoquinolin-8(5H)-one
55713-38-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 304.5±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.5±3.0 kJ/mol
Flash Point: 145.9±32.3 °C
Index of Refraction: 1.524
Molar Refractivity: 60.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 144.45
ACD/KOC (pH 5.5): 1073.27
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 227.23
ACD/KOC (pH 7.4): 1688.33
Polar Surface Area: 30 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 196.9±3.0 cm3

Click to predict properties on the Chemicalize site


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