ChemSpider 2D Image | 5-(4-Methyl-1H-pyrazol-1-yl)pentyl 1-pyrrolidinecarbodithioate | C14H23N3S2

5-(4-Methyl-1H-pyrazol-1-yl)pentyl 1-pyrrolidinecarbodithioate

  • Molecular FormulaC14H23N3S2
  • Average mass297.483 Da
  • Monoisotopic mass297.133331 Da
  • ChemSpider ID31974539

More details:

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

1-Pyrrolidinecarbodithioate de 5-(4-méthyl-1H-pyrazol-1-yl)pentyle [French] [ACD/IUPAC Name]
1-Pyrrolidinecarbodithioic acid, 5-(4-methyl-1H-pyrazol-1-yl)pentyl ester [ACD/Index Name]
5-(4-Methyl-1H-pyrazol-1-yl)pentyl 1-pyrrolidinecarbodithioate [ACD/IUPAC Name]
5-(4-Methyl-1H-pyrazol-1-yl)pentyl-1-pyrrolidincarbodithioat [German] [ACD/IUPAC 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: 435.7±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.3±29.3 °C
Index of Refraction: 1.622
Molar Refractivity: 87.9±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 3.00
ACD/BCF (pH 5.5): 111.68
ACD/KOC (pH 5.5): 1016.99
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 111.90
ACD/KOC (pH 7.4): 1018.98
Polar Surface Area: 78 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 249.6±7.0 cm3

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