ChemSpider 2D Image | 1-[(3E)-4-Bromo-3-buten-1-yn-1-yl]naphthalene | C14H9Br

1-[(3E)-4-Bromo-3-buten-1-yn-1-yl]naphthalene

  • Molecular FormulaC14H9Br
  • Average mass257.125 Da
  • Monoisotopic mass255.988754 Da
  • ChemSpider ID90425193

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(3E)-4-Brom-3-buten-1-in-1-yl]naphthalin [German] [ACD/IUPAC Name]
1-[(3E)-4-Bromo-3-butén-1-yn-1-yl]naphtalène [French] [ACD/IUPAC Name]
1-[(3E)-4-Bromo-3-buten-1-yn-1-yl]naphthalene [ACD/IUPAC Name]
Naphthalene, 1-[(3E)-4-bromo-3-buten-1-yn-1-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 347.1±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 162.8±20.1 °C
Index of Refraction: 1.687
Molar Refractivity: 68.5±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 5.17
ACD/BCF (pH 5.5): 4981.13
ACD/KOC (pH 5.5): 15421.97
ACD/LogD (pH 7.4): 5.17
ACD/BCF (pH 7.4): 4981.13
ACD/KOC (pH 7.4): 15421.97
Polar Surface Area: 0 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 53.6±5.0 dyne/cm
Molar Volume: 179.9±5.0 cm3

Click to predict properties on the Chemicalize site


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