ChemSpider 2D Image | 1-(Cyclopropylethynyl)-4-methoxybenzene | C12H12O

1-(Cyclopropylethynyl)-4-methoxybenzene

  • Molecular FormulaC12H12O
  • Average mass172.223 Da
  • Monoisotopic mass172.088821 Da
  • ChemSpider ID28418494

More details:

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

1-(Cyclopropylethinyl)-4-methoxybenzol [German] [ACD/IUPAC Name]
1-(Cyclopropylethynyl)-4-methoxybenzene [ACD/IUPAC Name]
1-(Cyclopropyléthynyl)-4-méthoxybenzène [French] [ACD/IUPAC Name]
Benzene, 1-(2-cyclopropylethynyl)-4-methoxy- [ACD/Index Name]
1-(2-cyclopropylethynyl)-4-methoxybenzene
85157-62-6 [RN]
MFCD22686848

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

Density: 1.1±0.1 g/cm3
Boiling Point: 277.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 49.5±3.0 kJ/mol
Flash Point: 116.3±18.3 °C
Index of Refraction: 1.568
Molar Refractivity: 52.2±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 170.45
ACD/KOC (pH 5.5): 1377.19
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 170.45
ACD/KOC (pH 7.4): 1377.19
Polar Surface Area: 9 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 42.8±5.0 dyne/cm
Molar Volume: 159.7±5.0 cm3

Click to predict properties on the Chemicalize site


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