ChemSpider 2D Image | 5-(5,5-dimethyl-1,3-dioxan-2-yl)-2'-valeronaphthone | C21H26O3

5-(5,5-dimethyl-1,3-dioxan-2-yl)-2'-valeronaphthone

  • Molecular FormulaC21H26O3
  • Average mass326.429 Da
  • Monoisotopic mass326.188202 Da
  • ChemSpider ID21402718

More details:

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

1-Pentanone, 5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-(2-naphthalenyl)- [ACD/Index Name]
5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(2-naphthalenyl)-1-pentanone
5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(2-naphthyl)-1-pentanon [German] [ACD/IUPAC Name]
5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(2-naphthyl)-1-pentanone [ACD/IUPAC Name]
5-(5,5-Diméthyl-1,3-dioxan-2-yl)-1-(2-naphtyl)-1-pentanone [French] [ACD/IUPAC Name]
5-(5,5-dimethyl-1,3-dioxan-2-yl)-2'-valeronaphthone
898756-41-7 [RN]
5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(naphthalen-2-yl)pentan-1-one
5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-naphthalen-2-ylpentan-1-one
MFCD03844327 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 462.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 225.7±8.2 °C
Index of Refraction: 1.543
Molar Refractivity: 97.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1261.74
ACD/KOC (pH 5.5): 5771.28
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1261.74
ACD/KOC (pH 7.4): 5771.28
Polar Surface Area: 36 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 41.5±3.0 dyne/cm
Molar Volume: 307.6±3.0 cm3

Click to predict properties on the Chemicalize site


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