ChemSpider 2D Image | 1-Benzyl-4-[3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxopropyl]piperidinium | C23H27N2OS

1-Benzyl-4-[3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxopropyl]piperidinium

  • Molecular FormulaC23H27N2OS
  • Average mass379.538 Da
  • Monoisotopic mass379.183868 Da
  • ChemSpider ID21219811

  • Charge - Charge

More details:

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

1-Benzyl-4-[3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxopropyl]piperidinium [ACD/IUPAC Name]
1-Benzyl-4-[3-(2-methyl-1,3-benzothiazol-6-yl)-3-oxopropyl]piperidinium [German] [ACD/IUPAC Name]
1-Benzyl-4-[3-(2-méthyl-1,3-benzothiazol-6-yl)-3-oxopropyl]pipéridinium [French] [ACD/IUPAC Name]
Piperidinium, 4-[3-(2-methyl-6-benzothiazolyl)-3-oxopropyl]-1-(phenylmethyl)- [ACD/Index Name]

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

Density:
Boiling Point: 520.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.4±3.0 kJ/mol
Flash Point: 268.8±23.2 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 2.07
ACD/KOC (pH 5.5): 8.82
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 61.48
ACD/KOC (pH 7.4): 262.43
Polar Surface Area: 63 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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