ChemSpider 2D Image | Metaescaline | C12H19NO3

Metaescaline

  • Molecular FormulaC12H19NO3
  • Average mass225.284 Da
  • Monoisotopic mass225.136490 Da
  • ChemSpider ID21106344

More details:

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

2-(3-Ethoxy-4,5-dimethoxyphenyl)ethanamin [German] [ACD/IUPAC Name]
2-(3-Ethoxy-4,5-dimethoxyphenyl)ethanamine [ACD/IUPAC Name]
2-(3-Éthoxy-4,5-diméthoxyphényl)éthanamine [French] [ACD/IUPAC Name]
3-Ethoxy-4,5-dimethoxybenzeneethanamine
90132-31-3 [RN]
Benzeneethanamine, 3-ethoxy-4,5-dimethoxy- [ACD/Index Name]
Metaescaline [Wiki]
2-(3-Ethoxy-4,5-dimethoxyphenyl)ethan-1-amine
2-(3-Ethoxy-4,5-dimethoxy-phenyl)-ethylamine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 327.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.0±3.0 kJ/mol
Flash Point: 153.4±20.2 °C
Index of Refraction: 1.509
Molar Refractivity: 64.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.43
ACD/LogD (pH 5.5): -1.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 214.4±3.0 cm3

Click to predict properties on the Chemicalize site


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