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Search term: IPMWSNYBFFSDEU (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-(2-Isopropyl-3-methoxyphenyl)ethanamine | C12H19NO

2-(2-Isopropyl-3-methoxyphenyl)ethanamine

  • Molecular FormulaC12H19NO
  • Average mass193.285 Da
  • Monoisotopic mass193.146667 Da
  • ChemSpider ID45550396

More details:

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

2-(2-Isopropyl-3-methoxyphenyl)ethanamin [German] [ACD/IUPAC Name]
2-(2-Isopropyl-3-methoxyphenyl)ethanamine [ACD/IUPAC Name]
2-(2-Isopropyl-3-méthoxyphényl)éthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 3-methoxy-2-(1-methylethyl)- [ACD/Index Name]
676500-58-6 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 290.4±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.0±3.0 kJ/mol
Flash Point: 121.7±17.3 °C
Index of Refraction: 1.514
Molar Refractivity: 60.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): -0.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.51
Polar Surface Area: 35 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 34.5±3.0 dyne/cm
Molar Volume: 200.0±3.0 cm3

Click to predict properties on the Chemicalize site


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