ChemSpider 2D Image | 3-[(5S)-2-Chloro-5-oxido-10H-phenothiazin-10-yl]-1-propanamine | C15H15ClN2OS

3-[(5S)-2-Chloro-5-oxido-10H-phenothiazin-10-yl]-1-propanamine

  • Molecular FormulaC15H15ClN2OS
  • Average mass306.810 Da
  • Monoisotopic mass306.059357 Da
  • ChemSpider ID122903800

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

10H-Phenothiazine-10-propanamine, 2-chloro-, 5-oxide, (5S)- [ACD/Index Name]
3-[(5S)-2-Chlor-5-oxido-10H-phenothiazin-10-yl]-1-propanamin [German] [ACD/IUPAC Name]
3-[(5S)-2-Chloro-5-oxido-10H-phenothiazin-10-yl]-1-propanamine [ACD/IUPAC Name]
3-[(5S)-2-Chloro-5-oxydo-10H-phénothiazin-10-yl]-1-propanamine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 516.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.8±3.0 kJ/mol
Flash Point: 265.9±30.1 °C
Index of Refraction: 1.731
Molar Refractivity: 84.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.11
Polar Surface Area: 66 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 79.2±5.0 dyne/cm
Molar Volume: 211.5±5.0 cm3

Click to predict properties on the Chemicalize site


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