ChemSpider 2D Image | (2S)-2-(4-Chlorophenyl)-4-[3-(isobutylsulfanyl)propyl]morpholine | C17H26ClNOS

(2S)-2-(4-Chlorophenyl)-4-[3-(isobutylsulfanyl)propyl]morpholine

  • Molecular FormulaC17H26ClNOS
  • Average mass327.912 Da
  • Monoisotopic mass327.142365 Da
  • ChemSpider ID77482980

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(4-Chlorophenyl)-4-[3-(isobutylsulfanyl)propyl]morpholine [ACD/IUPAC Name]
(2S)-2-(4-Chlorophényl)-4-[3-(isobutylsulfanyl)propyl]morpholine [French] [ACD/IUPAC Name]
(2S)-2-(4-Chlorphenyl)-4-[3-(isobutylsulfanyl)propyl]morpholin [German] [ACD/IUPAC Name]
Morpholine, 2-(4-chlorophenyl)-4-[3-[(2-methylpropyl)thio]propyl]-, (2S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 439.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 219.8±28.7 °C
Index of Refraction: 1.537
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 47.25
ACD/KOC (pH 5.5): 193.63
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1240.78
ACD/KOC (pH 7.4): 5084.36
Polar Surface Area: 38 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 299.1±3.0 cm3

Click to predict properties on the Chemicalize site


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