ChemSpider 2D Image | 10-{[1-Methyl(5,5-~2~H_2_)-3-pyrrolidinyl](~2~H_2_)methyl}-10H-phenothiazine | C18H16D4N2S

10-{[1-Methyl(5,5-2H2)-3-pyrrolidinyl](2H2)methyl}-10H-phenothiazine

  • Molecular FormulaC18H16D4N2S
  • Average mass300.454 Da
  • Monoisotopic mass300.159821 Da
  • ChemSpider ID78333847

  • Non-standard isotope - Non-standard isotope

More details:

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

10-{[1-Methyl(5,5-2H2)-3-pyrrolidinyl](2H2)methyl}-10H-phenothiazin [German] [ACD/IUPAC Name]
10-{[1-Methyl(5,5-2H2)-3-pyrrolidinyl](2H2)methyl}-10H-phenothiazine [ACD/IUPAC Name]
10-{[1-Méthyl(5,5-2H2)-3-pyrrolidinyl](2H2)méthyl}-10H-phénothiazine [French] [ACD/IUPAC Name]
10H-Phenothiazine, 10-[(1-methyl-3-pyrrolidinyl-5,5-d2)methyl-d2]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 430.4±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 214.1±22.9 °C
Index of Refraction: 1.642
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 2.00
ACD/KOC (pH 5.5): 7.59
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 7.93
ACD/KOC (pH 7.4): 30.14
Polar Surface Area: 32 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 250.0±3.0 cm3

Click to predict properties on the Chemicalize site


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