ChemSpider 2D Image | METOPIMAZINE ACID | C22H26N2O4S2

METOPIMAZINE ACID

  • Molecular FormulaC22H26N2O4S2
  • Average mass446.583 Da
  • Monoisotopic mass446.133392 Da
  • ChemSpider ID23976829

More details:

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

1-{3-[2-(Methylsulfonyl)-10H-phenothiazin-10-yl]propyl}-4-piperidincarbonsäure [German] [ACD/IUPAC Name]
1-{3-[2-(Methylsulfonyl)-10H-phenothiazin-10-yl]propyl}-4-piperidinecarboxylic acid [ACD/IUPAC Name]
18182-00-8 [RN]
4-Piperidinecarboxylic acid, 1-[3-[2-(methylsulfonyl)-10H-phenothiazin-10-yl]propyl]- [ACD/Index Name]
Acide 1-{3-[2-(méthylsulfonyl)-10H-phénothiazin-10-yl]propyl}-4-pipéridinecarboxylique [French] [ACD/IUPAC Name]
METOPIMAZINE ACID
1-[3-(2-METHANESULFONYL-10H-PHENOTHIAZIN-10-YL)PROPYL]PIPERIDIN-1-IUM-4-CARBOXYLATE
1-[3-(2-METHANESULFONYLPHENOTHIAZIN-10-YL)PROPYL]PIPERIDIN-1-IUM-4-CARBOXYLATE
1-[3-(2-methylsulfonylphenothiazin-10-yl)propyl]piperidine-4-carboxylic acid
1-[3-[2-(Methylsulfonyl)-10H-phenothiazin-10-yl]propyl]-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 695.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.0±3.0 kJ/mol
Flash Point: 374.5±31.5 °C
Index of Refraction: 1.627
Molar Refractivity: 119.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 1.11
ACD/KOC (pH 5.5): 7.27
ACD/LogD (pH 7.4): 1.15
ACD/BCF (pH 7.4): 1.12
ACD/KOC (pH 7.4): 7.33
Polar Surface Area: 112 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 338.3±3.0 cm3

Click to predict properties on the Chemicalize site


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