ChemSpider 2D Image | (3R)-1-Hexen-3-yl acetate | C8H14O2

(3R)-1-Hexen-3-yl acetate

  • Molecular FormulaC8H14O2
  • Average mass142.196 Da
  • Monoisotopic mass142.099380 Da
  • ChemSpider ID57505396

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-1-Hexen-3-yl acetate [ACD/IUPAC Name]
(3R)-1-Hexen-3-yl-acetat [German] [ACD/IUPAC Name]
1-Hexen-3-ol, acetate, (3R)- [ACD/Index Name]
Acétate de (3R)-1-hexén-3-yle [French] [ACD/IUPAC Name]
1-HEXEN-3-OL, ACETATE, (R)-
62247-45-4 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 164.6±9.0 °C at 760 mmHg
Vapour Pressure: 1.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.1±3.0 kJ/mol
Flash Point: 55.4±12.3 °C
Index of Refraction: 1.422
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.80
ACD/KOC (pH 5.5): 778.29
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.80
ACD/KOC (pH 7.4): 778.29
Polar Surface Area: 26 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 26.4±3.0 dyne/cm
Molar Volume: 159.5±3.0 cm3

Click to predict properties on the Chemicalize site


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