ChemSpider 2D Image | (2E)-3-[(2,2-Dichloro-1,1-difluoroethyl)sulfanyl]-2-[(1-hydroxyvinyl)imino]-1,1-propanediol | C7H9Cl2F2NO3S

(2E)-3-[(2,2-Dichloro-1,1-difluoroethyl)sulfanyl]-2-[(1-hydroxyvinyl)imino]-1,1-propanediol

  • Molecular FormulaC7H9Cl2F2NO3S
  • Average mass296.119 Da
  • Monoisotopic mass294.964813 Da
  • ChemSpider ID95675333

More details:

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

(2E)-3-[(2,2-Dichlor-1,1-difluorethyl)sulfanyl]-2-[(1-hydroxyvinyl)imino]-1,1-propandiol [German] [ACD/IUPAC Name]
(2E)-3-[(2,2-Dichloro-1,1-difluoroethyl)sulfanyl]-2-[(1-hydroxyvinyl)imino]-1,1-propanediol [ACD/IUPAC Name]
(2E)-3-[(2,2-Dichloro-1,1-difluoroéthyl)sulfanyl]-2-[(1-hydroxyvinyl)imino]-1,1-propanediol [French] [ACD/IUPAC Name]
1,1-Propanediol, 3-[(2,2-dichloro-1,1-difluoroethyl)thio]-2-[(1-hydroxyethenyl)imino]-, (2E)- [ACD/Index 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: 373.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.9±6.0 kJ/mol
Flash Point: 179.9±27.9 °C
Index of Refraction: 1.533
Molar Refractivity: 57.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 2.59
ACD/BCF (pH 5.5): 55.11
ACD/KOC (pH 5.5): 613.70
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 54.82
ACD/KOC (pH 7.4): 610.46
Polar Surface Area: 98 Å2
Polarizability: 22.8±0.5 10-24cm3
Surface Tension: 43.6±7.0 dyne/cm
Molar Volume: 185.4±7.0 cm3

Click to predict properties on the Chemicalize site


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