ChemSpider 2D Image | (3S)-1-Octen-3-yl acetate | C10H18O2

(3S)-1-Octen-3-yl acetate

  • Molecular FormulaC10H18O2
  • Average mass170.249 Da
  • Monoisotopic mass170.130676 Da
  • ChemSpider ID32787026

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-1-Octen-3-yl acetate [ACD/IUPAC Name]
(3S)-1-Octen-3-yl-acetat [German] [ACD/IUPAC Name]
1-Octen-3-ol, acetate, (3S)- [ACD/Index Name]
Acétate de (3S)-1-octén-3-yle [French] [ACD/IUPAC Name]
(3S)-OCT-1-EN-3-YL ACETATE
[(1R)-1-vinylhexyl] acetate
[(3R)-oct-1-en-3-yl] acetate
[(3R)-oct-1-en-3-yl] ethanoate
1-Octen-3-yl acetate [ACD/IUPAC Name] [Wiki]
219-474-7 [EINECS]
More...

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

Density: 0.9±0.1 g/cm3
Boiling Point: 208.5±9.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.4 mmHg at 25°C
Enthalpy of Vaporization: 44.5±3.0 kJ/mol
Flash Point: 78.6±12.3 °C
Index of Refraction: 1.431
Molar Refractivity: 49.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 403.35
ACD/KOC (pH 5.5): 2551.24
ACD/LogD (pH 7.4): 3.73
ACD/BCF (pH 7.4): 403.35
ACD/KOC (pH 7.4): 2551.24
Polar Surface Area: 26 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 27.5±3.0 dyne/cm
Molar Volume: 192.6±3.0 cm3

Click to predict properties on the Chemicalize site


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