ChemSpider 2D Image | 2-Cyclopropyl-5-{[2-(1-methyl-2-pyrrolidinyl)ethyl]sulfanyl}-1,3,4-thiadiazole | C12H19N3S2

2-Cyclopropyl-5-{[2-(1-methyl-2-pyrrolidinyl)ethyl]sulfanyl}-1,3,4-thiadiazole

  • Molecular FormulaC12H19N3S2
  • Average mass269.429 Da
  • Monoisotopic mass269.102051 Da
  • ChemSpider ID30126667

More details:

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

1,3,4-Thiadiazole, 2-cyclopropyl-5-[[2-(1-methyl-2-pyrrolidinyl)ethyl]thio]- [ACD/Index Name]
2-Cyclopropyl-5-{[2-(1-methyl-2-pyrrolidinyl)ethyl]sulfanyl}-1,3,4-thiadiazol [German] [ACD/IUPAC Name]
2-Cyclopropyl-5-{[2-(1-methyl-2-pyrrolidinyl)ethyl]sulfanyl}-1,3,4-thiadiazole [ACD/IUPAC Name]
2-Cyclopropyl-5-{[2-(1-méthyl-2-pyrrolidinyl)éthyl]sulfanyl}-1,3,4-thiadiazole [French] [ACD/IUPAC 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: 407.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 200.0±26.5 °C
Index of Refraction: 1.615
Molar Refractivity: 74.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -0.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.51
Polar Surface Area: 83 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 213.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement