ChemSpider 2D Image | Methallylescaline | C14H21NO3

Methallylescaline

  • Molecular FormulaC14H21NO3
  • Average mass251.321 Da
  • Monoisotopic mass251.152145 Da
  • ChemSpider ID21106346

More details:






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

2-[3,5-Dimethoxy-4-(2-methyl-allyloxy)-phenyl]-ethylamine
2-{3,5-Dimethoxy-4-[(2-methyl-2-propen-1-yl)oxy]phenyl}ethanamin [German] [ACD/IUPAC Name]
2-{3,5-Dimethoxy-4-[(2-methyl-2-propen-1-yl)oxy]phenyl}ethanamine [ACD/IUPAC Name]
2-{3,5-Diméthoxy-4-[(2-méthyl-2-propén-1-yl)oxy]phényl}éthanamine [French] [ACD/IUPAC Name]
2-{3,5-dimethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}ethanamine [ACD/IUPAC Name]
4-methallyloxy-3,5-dimethoxyphenethylamine
Benzeneethanamine, 3,5-dimethoxy-4-[(2-methyl-2-propen-1-yl)oxy]- [ACD/Index Name]
Methallylescaline [Wiki]
2-[3,5-Dimethoxy-4-(2-methyl-allyloxy)-phenyl]-ethylamine HCl
2-{3,5-Dimethoxy-4-[(2-methylprop-2-en-1-yl)oxy]phenyl}ethan-1-amine
More...

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

CCRIS 4693 [DBID]
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-10471]
    • Safety:

      20/21/22 Novochemy [NC-10471]
      20/21/36/37/39 Novochemy [NC-10471]
      GHS07; GHS09 Novochemy [NC-10471]
      H304; H332; H403 Novochemy [NC-10471]
      P332+P313; P305+P351+P338 Novochemy [NC-10471]
      R22 Novochemy [NC-10471]
      Warning Novochemy [NC-10471]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 363.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.9±3.0 kJ/mol
Flash Point: 174.4±20.2 °C
Index of Refraction: 1.513
Molar Refractivity: 72.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): -1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.67
Polar Surface Area: 54 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 242.4±3.0 cm3

Click to predict properties on the Chemicalize site





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