ChemSpider 2D Image | (2Z)-4-(2-Phenoxathiinyl)-N-(4-propylphenyl)-2-[(4-propylphenyl)imino]-1,3-thiazol-3(2H)-amine | C33H31N3OS2

(2Z)-4-(2-Phenoxathiinyl)-N-(4-propylphenyl)-2-[(4-propylphenyl)imino]-1,3-thiazol-3(2H)-amine

  • Molecular FormulaC33H31N3OS2
  • Average mass549.749 Da
  • Monoisotopic mass549.190857 Da
  • ChemSpider ID73963594

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-4-(2-Phenoxathiinyl)-N-(4-propylphenyl)-2-[(4-propylphenyl)imino]-1,3-thiazol-3(2H)-amin [German] [ACD/IUPAC Name]
(2Z)-4-(2-Phenoxathiinyl)-N-(4-propylphenyl)-2-[(4-propylphenyl)imino]-1,3-thiazol-3(2H)-amine [ACD/IUPAC Name]
(2Z)-4-(2-Phénoxathiinyl)-N-(4-propylphényl)-2-[(4-propylphényl)imino]-1,3-thiazol-3(2H)-amine [French] [ACD/IUPAC Name]
3(2H)-Thiazolamine, 4-(2-phenoxathiinyl)-N-(4-propylphenyl)-2-[(4-propylphenyl)imino]-, (2Z)- [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: 690.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.3±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 166.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 11.54
ACD/LogD (pH 5.5): 9.25
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2575754.25
ACD/LogD (pH 7.4): 9.25
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2575779.50
Polar Surface Area: 87 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 48.5±7.0 dyne/cm
Molar Volume: 445.9±7.0 cm3

Click to predict properties on the Chemicalize site


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