ChemSpider 2D Image | MFCD11973894 | C17H13D6ClN2S

MFCD11973894

  • Molecular FormulaC17H13D6ClN2S
  • Average mass324.901 Da
  • Monoisotopic mass324.133392 Da
  • ChemSpider ID49073121
  • Non-standard isotope - Non-standard isotope


More details:






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

10H-Phenothiazine-10-propanamine, 2-chloro-N,N-di(methyl-d3)- [ACD/Index Name]
1276197-23-9 [RN]
3-(2-Chlor-10H-phenothiazin-10-yl)-N,N-bis[(2H3)methyl]-1-propanamin [German] [ACD/IUPAC Name]
3-(2-Chloro-10H-phenothiazin-10-yl)-N,N-bis[(2H3)methyl]-1-propanamine [ACD/IUPAC Name]
3-(2-Chloro-10H-phénothiazin-10-yl)-N,N-bis[(2H3)méthyl]-1-propanamine [French] [ACD/IUPAC Name]
Chlorpromazine-(dimethyl-d6) oxalate
MFCD11973894
3-(2-Chloro-10H-phenothiazin-10-yl)-N,N-bis[(2H3)methyl]propan-1-amine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 450.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.0±28.7 °C
Index of Refraction: 1.623
Molar Refractivity: 92.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.20
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 6.51
ACD/KOC (pH 5.5): 18.29
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 80.07
ACD/KOC (pH 7.4): 225.08
Polar Surface Area: 32 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 46.6±3.0 dyne/cm
Molar Volume: 262.9±3.0 cm3

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