ChemSpider 2D Image | Diethyl acetamido(6-octyl-1-oxo-1,2,3,4-tetrahydro-2-naphthalenyl)malonate | C27H39NO6

Diethyl acetamido(6-octyl-1-oxo-1,2,3,4-tetrahydro-2-naphthalenyl)malonate

  • Molecular FormulaC27H39NO6
  • Average mass473.602 Da
  • Monoisotopic mass473.277740 Da
  • ChemSpider ID28600453

More details:

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

1,3-Diethyl 2-(acetylamino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)propanedioate
945632-79-1 [RN]
Acétamido(6-octyl-1-oxo-1,2,3,4-tétrahydro-2-naphtalényl)malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl acetamido(6-octyl-1-oxo-1,2,3,4-tetrahydro-2-naphthalenyl)malonate [ACD/IUPAC Name]
Diethyl-acetamido(6-octyl-1-oxo-1,2,3,4-tetrahydro-2-naphthalinyl)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(acetylamino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, diethyl ester [ACD/Index Name]
1,3-DIETHYL 2-ACETAMIDO-2-(6-OCTYL-1-OXO-3,4-DIHYDRO-2H-NAPHTHALEN-2-YL)PROPANEDIOATE
Diethyl 2-acetamido-2-(6-octyl-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)malonate
Diethyl acetamido(6-octyl-1-oxo-1,2,3,4-tetrahydronaphthalen-2-yl)propanedioate
Propanedioic acid, 2-(acetylamino)-2-(1,2,3,4-tetrahydro-6-octyl-1-oxo-2-naphthalenyl)-, 1,3-diethyl ester

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

Density: 1.1±0.1 g/cm3
Boiling Point: 603.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 318.6±31.5 °C
Index of Refraction: 1.517
Molar Refractivity: 129.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 6.92
ACD/BCF (pH 5.5): 106649.39
ACD/KOC (pH 5.5): 138226.45
ACD/LogD (pH 7.4): 6.92
ACD/BCF (pH 7.4): 106640.96
ACD/KOC (pH 7.4): 138215.52
Polar Surface Area: 99 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 426.3±3.0 cm3

Click to predict properties on the Chemicalize site


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