ChemSpider 2D Image | MFCD09865779 | C19H28O5S

MFCD09865779

  • Molecular FormulaC19H28O5S
  • Average mass368.488 Da
  • Monoisotopic mass368.165741 Da
  • ChemSpider ID22898154

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-7-(Tetrahydro-2H-pyran-2-yloxy)-3-hepten-1-yl 4-methylbenzenesulfonate [ACD/IUPAC Name]
(3Z)-7-(Tetrahydro-2H-pyran-2-yloxy)-3-hepten-1-yl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
(3Z)-7-(TETRAHYDRO-2H-PYRAN-2-YLOXY)-3-HEPTENYL 4-METHYLBENZENESULFONATE
3-Hepten-1-ol, 7-[(tetrahydro-2H-pyran-2-yl)oxy]-, 4-methylbenzenesulfonate, (3Z)- [ACD/Index Name]
4-Méthylbenzènesulfonate de (3Z)-7-(tétrahydro-2H-pyran-2-yloxy)-3-heptén-1-yle [French] [ACD/IUPAC Name]
MFCD09865779

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

Density: 1.2±0.1 g/cm3
Boiling Point: 511.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 263.4±30.1 °C
Index of Refraction: 1.539
Molar Refractivity: 98.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 3.40
ACD/BCF (pH 5.5): 227.59
ACD/KOC (pH 5.5): 1693.80
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 227.59
ACD/KOC (pH 7.4): 1693.80
Polar Surface Area: 70 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 315.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement