ChemSpider 2D Image | 3-(2,5-Dimethoxy-4-methylphenyl)-2-butanamine | C13H21NO2

3-(2,5-Dimethoxy-4-methylphenyl)-2-butanamine

  • Molecular FormulaC13H21NO2
  • Average mass223.311 Da
  • Monoisotopic mass223.157227 Da
  • ChemSpider ID75117994

More details:

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

3-(2,5-Dimethoxy-4-methylphenyl)-2-butanamin [German] [ACD/IUPAC Name]
3-(2,5-Dimethoxy-4-methylphenyl)-2-butanamine [ACD/IUPAC Name]
3-(2,5-Diméthoxy-4-méthylphényl)-2-butanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2,5-dimethoxy-α,β,4-trimethyl- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 336.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.9±3.0 kJ/mol
Flash Point: 172.2±35.2 °C
Index of Refraction: 1.507
Molar Refractivity: 66.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.49
ACD/LogD (pH 5.5): -0.40
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): 3.03
Polar Surface Area: 44 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 224.3±3.0 cm3

Click to predict properties on the Chemicalize site


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