ChemSpider 2D Image | 2-Allyl-1,3,4-trimethoxybenzene | C12H16O3

2-Allyl-1,3,4-trimethoxybenzene

  • Molecular FormulaC12H16O3
  • Average mass208.254 Da
  • Monoisotopic mass208.109940 Da
  • ChemSpider ID57587128

More details:

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

1,2,4-Trimethoxy-3-(2-propen-1-yl)benzene
2-Allyl-1,3,4-trimethoxybenzene [ACD/IUPAC Name]
2-Allyl-1,3,4-triméthoxybenzène [French] [ACD/IUPAC Name]
2-Allyl-1,3,4-trimethoxybenzol [German] [ACD/IUPAC Name]
5353-16-2 [RN]
Benzene, 1,2,4-trimethoxy-3-(2-propen-1-yl)- [ACD/Index Name]
1,2,4-trimethoxy-3-(prop-2-en-1-yl)benzene

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

Density: 1.0±0.1 g/cm3
Boiling Point: 277.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.5±3.0 kJ/mol
Flash Point: 91.7±23.2 °C
Index of Refraction: 1.497
Molar Refractivity: 60.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 56.12
ACD/KOC (pH 5.5): 621.77
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 56.12
ACD/KOC (pH 7.4): 621.77
Polar Surface Area: 28 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 30.2±3.0 dyne/cm
Molar Volume: 205.9±3.0 cm3

Click to predict properties on the Chemicalize site


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