ChemSpider 2D Image | 5-[(2-Chloro-4-nitrophenyl)sulfanyl]-N-(tetrahydro-2-furanylmethyl)-1,3,4-thiadiazol-2-amine | C13H13ClN4O3S2

5-[(2-Chloro-4-nitrophenyl)sulfanyl]-N-(tetrahydro-2-furanylmethyl)-1,3,4-thiadiazol-2-amine

  • Molecular FormulaC13H13ClN4O3S2
  • Average mass372.850 Da
  • Monoisotopic mass372.011749 Da
  • ChemSpider ID22055155

More details:

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

1,3,4-Thiadiazol-2-amine, 5-[(2-chloro-4-nitrophenyl)thio]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
5-[(2-Chlor-4-nitrophenyl)sulfanyl]-N-(tetrahydro-2-furanylmethyl)-1,3,4-thiadiazol-2-amin [German] [ACD/IUPAC Name]
5-[(2-Chloro-4-nitrophenyl)sulfanyl]-N-(tetrahydro-2-furanylmethyl)-1,3,4-thiadiazol-2-amine [ACD/IUPAC Name]
5-[(2-Chloro-4-nitrophényl)sulfanyl]-N-(tétrahydro-2-furanylméthyl)-1,3,4-thiadiazol-2-amine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 552.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.3±3.0 kJ/mol
Flash Point: 287.8±32.9 °C
Index of Refraction: 1.680
Molar Refractivity: 90.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 3.93
ACD/BCF (pH 5.5): 567.20
ACD/KOC (pH 5.5): 3256.30
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 567.21
ACD/KOC (pH 7.4): 3256.35
Polar Surface Area: 146 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 79.5±5.0 dyne/cm
Molar Volume: 239.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement