ChemSpider 2D Image | 3-Methoxy-N-[2-(2,2,6,6-tetramethyl-4-phenyltetrahydro-2H-thiopyran-4-yl)ethyl]aniline | C24H33NOS

3-Methoxy-N-[2-(2,2,6,6-tetramethyl-4-phenyltetrahydro-2H-thiopyran-4-yl)ethyl]aniline

  • Molecular FormulaC24H33NOS
  • Average mass383.590 Da
  • Monoisotopic mass383.228271 Da
  • ChemSpider ID26632188

More details:

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

2H-Thiopyran-4-ethanamine, tetrahydro-N-(3-methoxyphenyl)-2,2,6,6-tetramethyl-4-phenyl- [ACD/Index Name]
3-Methoxy-N-[2-(2,2,6,6-tetramethyl-4-phenyltetrahydro-2H-thiopyran-4-yl)ethyl]anilin [German] [ACD/IUPAC Name]
3-Methoxy-N-[2-(2,2,6,6-tetramethyl-4-phenyltetrahydro-2H-thiopyran-4-yl)ethyl]aniline [ACD/IUPAC Name]
3-Méthoxy-N-[2-(2,2,6,6-tétraméthyl-4-phényltétrahydro-2H-thiopyrane-4-yl)éthyl]aniline [French] [ACD/IUPAC 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: 510.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.2±3.0 kJ/mol
Flash Point: 262.7±28.7 °C
Index of Refraction: 1.557
Molar Refractivity: 119.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.64
ACD/LogD (pH 5.5): 6.73
ACD/BCF (pH 5.5): 75045.18
ACD/KOC (pH 5.5): 105131.72
ACD/LogD (pH 7.4): 6.76
ACD/BCF (pH 7.4): 81034.14
ACD/KOC (pH 7.4): 113521.73
Polar Surface Area: 47 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 370.8±3.0 cm3

Click to predict properties on the Chemicalize site


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