ChemSpider 2D Image | (1E)-1-Propene-1--SO-thioperoxol | C3H6OS

(1E)-1-Propene-1--SO-thioperoxol

  • Molecular FormulaC3H6OS
  • Average mass90.144 Da
  • Monoisotopic mass90.013931 Da
  • ChemSpider ID15421666

  • Double-bond stereo - Double-bond stereo

More details:

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

(1E)-1-Propen-1--SO-thioperoxol [German] [ACD/IUPAC Name]
(1E)-1-Propene-1--SO-thioperoxol [ACD/IUPAC Name]
(1E)-1-Propène-1--SO-thioperoxol [French] [ACD/IUPAC Name]
1-Propene-1-sulfenic acid, (1E)- [ACD/Index Name]
(E) 1-propenylsulfenate
(E) 1-propenylsulfenic acid
(1E)-prop-1-ene-1-SO-thioperoxol
(E)-1-Propene-1-sulfenic acid
trans 1-propenylsulfenate
1-propenylsulfenate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.1±0.1 g/cm3
Boiling Point: 161.3±23.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.6 mmHg at 25°C
Enthalpy of Vaporization: 46.3±6.0 kJ/mol
Flash Point: 79.5±21.3 °C
Index of Refraction: 1.526
Molar Refractivity: 25.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.86
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.03
ACD/KOC (pH 5.5): 76.89
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.03
ACD/KOC (pH 7.4): 76.85
Polar Surface Area: 46 Å2
Polarizability: 10.1±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 83.1±3.0 cm3

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