ChemSpider 2D Image | (2Z)-3,7-Dimethyl-2,6-octadien-1-yl 2-ethylbutanoate | C16H28O2

(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 2-ethylbutanoate

  • Molecular FormulaC16H28O2
  • Average mass252.392 Da
  • Monoisotopic mass252.208923 Da
  • ChemSpider ID30777242

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3,7-Dimethyl-2,6-octadien-1-yl 2-ethylbutanoate [ACD/IUPAC Name]
(2Z)-3,7-Dimethyl-2,6-octadien-1-yl-2-ethylbutanoat [German] [ACD/IUPAC Name]
2-Éthylbutanoate de (2Z)-3,7-diméthyl-2,6-octadién-1-yle [French] [ACD/IUPAC Name]
Butanoic acid, 2-ethyl-, (2Z)-3,7-dimethyl-2,6-octadien-1-yl ester [ACD/Index Name]
(2Z)-3,7-dimethylocta-2,6-dien-1-yl 2-ethylbutanoate
(E)-3,7-Dimethyl-2,6-octadienyl 2-ethylbutanoate
(E)-3,7-dimethylocta-2,6-dienyl 2-ethylbutyrate
3,7-Dimethylocta-2,6-dienyl 2-ethylbutanoate
3,7-Dimethylocta-2,6-dienyl 2-ethylbutyrate [ACD/IUPAC Name]
73019-14-4 [RN]
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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: 0.9±0.1 g/cm3
Boiling Point: 328.7±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 98.4±20.4 °C
Index of Refraction: 1.461
Molar Refractivity: 77.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 6.05
ACD/LogD (pH 5.5): 5.13
ACD/BCF (pH 5.5): 4692.31
ACD/KOC (pH 5.5): 14776.51
ACD/LogD (pH 7.4): 5.13
ACD/BCF (pH 7.4): 4692.31
ACD/KOC (pH 7.4): 14776.51
Polar Surface Area: 26 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 29.0±3.0 dyne/cm
Molar Volume: 283.3±3.0 cm3

Click to predict properties on the Chemicalize site


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