ChemSpider 2D Image | Allylescaline | C13H19NO3

Allylescaline

  • Molecular FormulaC13H19NO3
  • Average mass237.295 Da
  • Monoisotopic mass237.136490 Da
  • ChemSpider ID21106254

More details:






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

2-(4-Allyloxy-3,5-dimethoxy-phenyl)-ethylamine
2-[4-(Allyloxy)-3,5-dimethoxyphenyl]ethanamin [German] [ACD/IUPAC Name]
2-[4-(Allyloxy)-3,5-dimethoxyphenyl]ethanamine [ACD/IUPAC Name]
2-[4-(Allyloxy)-3,5-diméthoxyphényl]éthanamine [French] [ACD/IUPAC Name]
4-Allyloxy-3,5-dimethoxyphenethylamine
Allylescaline [Wiki]
Benzeneethanamine, 3,5-dimethoxy-4-(2-propen-1-yloxy)- [ACD/Index Name]
3,5-Dimethoxy-4-(2-propenyloxy)benzeneethanamine
3,5-Dimethoxy-4-(2-propenyloxy)benzeneethanamine hydrochloride
39201-75-7 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 348.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.3±3.0 kJ/mol
Flash Point: 167.5±20.2 °C
Index of Refraction: 1.517
Molar Refractivity: 68.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.70
ACD/LogD (pH 5.5): -1.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.08
Polar Surface Area: 54 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 226.0±3.0 cm3

Click to predict properties on the Chemicalize site





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