ChemSpider 2D Image | 1-Methoxy-4-{[(4-methylene-1-octyn-3-yl)oxy]methyl}benzene | C17H22O2

1-Methoxy-4-{[(4-methylene-1-octyn-3-yl)oxy]methyl}benzene

  • Molecular FormulaC17H22O2
  • Average mass258.355 Da
  • Monoisotopic mass258.161987 Da
  • ChemSpider ID30992571

More details:






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

1-Methoxy-4-{[(4-methylen-1-octin-3-yl)oxy]methyl}benzol [German] [ACD/IUPAC Name]
1-Methoxy-4-{[(4-methylene-1-octyn-3-yl)oxy]methyl}benzene [ACD/IUPAC Name]
1-Méthoxy-4-{[(4-méthylène-1-octyn-3-yl)oxy]méthyl}benzène [French] [ACD/IUPAC Name]
Benzene, 1-[[(1-ethynyl-2-methylenehexyl)oxy]methyl]-4-methoxy- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 360.1±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 129.2±24.6 °C
Index of Refraction: 1.508
Molar Refractivity: 78.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 5.18
ACD/BCF (pH 5.5): 5064.24
ACD/KOC (pH 5.5): 15605.73
ACD/LogD (pH 7.4): 5.18
ACD/BCF (pH 7.4): 5064.24
ACD/KOC (pH 7.4): 15605.73
Polar Surface Area: 18 Å2
Polarizability: 31.2±0.5 10-24cm3
Surface Tension: 34.7±3.0 dyne/cm
Molar Volume: 263.7±3.0 cm3

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