ChemSpider 2D Image | (1S)-1-(3,4-Dimethoxyphenyl)-2-propen-1-ol | C11H14O3

(1S)-1-(3,4-Dimethoxyphenyl)-2-propen-1-ol

  • Molecular FormulaC11H14O3
  • Average mass194.227 Da
  • Monoisotopic mass194.094299 Da
  • ChemSpider ID75001946

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-(3,4-Dimethoxyphenyl)-2-propen-1-ol [German] [ACD/IUPAC Name]
(1S)-1-(3,4-Dimethoxyphenyl)-2-propen-1-ol [ACD/IUPAC Name]
(1S)-1-(3,4-Diméthoxyphényl)-2-propén-1-ol [French] [ACD/IUPAC Name]
Benzenemethanol, α-ethenyl-3,4-dimethoxy-, (αS)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 306.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.7±3.0 kJ/mol
Flash Point: 139.0±27.9 °C
Index of Refraction: 1.523
Molar Refractivity: 55.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.48
ACD/LogD (pH 5.5): 1.44
ACD/BCF (pH 5.5): 7.30
ACD/KOC (pH 5.5): 144.35
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 7.30
ACD/KOC (pH 7.4): 144.35
Polar Surface Area: 39 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 180.1±3.0 cm3

Click to predict properties on the Chemicalize site


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