ChemSpider 2D Image | (5-Anilino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)(4-methoxyphenyl)methanone | C18H19N3O2S

(5-Anilino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)(4-methoxyphenyl)methanone

  • Molecular FormulaC18H19N3O2S
  • Average mass341.427 Da
  • Monoisotopic mass341.119812 Da
  • ChemSpider ID21126302

More details:

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

(5-Anilino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)(4-methoxyphenyl)methanon [German] [ACD/IUPAC Name]
(5-Anilino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)(4-methoxyphenyl)methanone [ACD/IUPAC Name]
(5-Anilino-2,2-diméthyl-1,3,4-thiadiazol-3(2H)-yl)(4-méthoxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [2,2-dimethyl-5-(phenylamino)-1,3,4-thiadiazol-3(2H)-yl](4-methoxyphenyl)- [ACD/Index 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: 475.1±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.9±3.0 kJ/mol
Flash Point: 241.2±29.3 °C
Index of Refraction: 1.622
Molar Refractivity: 97.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.44
ACD/LogD (pH 5.5): 3.04
ACD/BCF (pH 5.5): 120.15
ACD/KOC (pH 5.5): 1072.14
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 120.17
ACD/KOC (pH 7.4): 1072.35
Polar Surface Area: 79 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 46.3±7.0 dyne/cm
Molar Volume: 278.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement