ChemSpider 2D Image | (2E)-2-[(1-Hydroxyvinyl)imino]-3-[(pentachlorophenyl)sulfanyl]-1,1-propanediol | C11H8Cl5NO3S

(2E)-2-[(1-Hydroxyvinyl)imino]-3-[(pentachlorophenyl)sulfanyl]-1,1-propanediol

  • Molecular FormulaC11H8Cl5NO3S
  • Average mass411.516 Da
  • Monoisotopic mass408.866760 Da
  • ChemSpider ID95771874

More details:

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

(2E)-2-[(1-Hydroxyvinyl)imino]-3-[(pentachlorophenyl)sulfanyl]-1,1-propanediol [ACD/IUPAC Name]
(2E)-2-[(1-Hydroxyvinyl)imino]-3-[(pentachlorophényl)sulfanyl]-1,1-propanediol [French] [ACD/IUPAC Name]
(2E)-2-[(1-Hydroxyvinyl)imino]-3-[(pentachlorphenyl)sulfanyl]-1,1-propandiol [German] [ACD/IUPAC Name]
1,1-Propanediol, 2-[(1-hydroxyethenyl)imino]-3-[(2,3,4,5,6-pentachlorophenyl)thio]-, (2E)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 495.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 253.7±28.7 °C
Index of Refraction: 1.651
Molar Refractivity: 86.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 4.83
ACD/BCF (pH 5.5): 2750.08
ACD/KOC (pH 5.5): 10080.16
ACD/LogD (pH 7.4): 4.83
ACD/BCF (pH 7.4): 2739.60
ACD/KOC (pH 7.4): 10041.78
Polar Surface Area: 98 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 54.7±7.0 dyne/cm
Molar Volume: 238.0±7.0 cm3

Click to predict properties on the Chemicalize site


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