ChemSpider 2D Image | 3-{[(1-Isopropyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1-methylpiperidine | C11H21N5S

3-{[(1-Isopropyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1-methylpiperidine

  • Molecular FormulaC11H21N5S
  • Average mass255.383 Da
  • Monoisotopic mass255.151764 Da
  • ChemSpider ID30168715

More details:

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

3-{[(1-Isopropyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1-methylpiperidin [German] [ACD/IUPAC Name]
3-{[(1-Isopropyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1-methylpiperidine [ACD/IUPAC Name]
3-{[(1-Isopropyl-1H-tétrazol-5-yl)sulfanyl]méthyl}-1-méthylpipéridine [French] [ACD/IUPAC Name]
Piperidine, 1-methyl-3-[[[1-(1-methylethyl)-1H-tetrazol-5-yl]thio]methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 388.8±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.8±3.0 kJ/mol
Flash Point: 189.0±25.7 °C
Index of Refraction: 1.643
Molar Refractivity: 72.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): -1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.70
Polar Surface Area: 72 Å2
Polarizability: 28.7±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 200.3±7.0 cm3

Click to predict properties on the Chemicalize site


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