ChemSpider 2D Image | (4S)-2,4-Dimethyl-1-heptene | C9H18

(4S)-2,4-Dimethyl-1-heptene

  • Molecular FormulaC9H18
  • Average mass126.239 Da
  • Monoisotopic mass126.140854 Da
  • ChemSpider ID113059836

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-2,4-Dimethyl-1-hepten [German] [ACD/IUPAC Name]
(4S)-2,4-Dimethyl-1-heptene [ACD/IUPAC Name]
(4S)-2,4-Diméthyl-1-heptène [French] [ACD/IUPAC Name]
1-Heptene, 2,4-dimethyl-, (4S)- [ACD/Index Name]

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

Density: 0.7±0.1 g/cm3
Boiling Point: 137.3±7.0 °C at 760 mmHg
Vapour Pressure: 8.8±0.1 mmHg at 25°C
Enthalpy of Vaporization: 35.9±0.8 kJ/mol
Flash Point: 22.7±8.1 °C
Index of Refraction: 1.416
Molar Refractivity: 43.3±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 4.26
ACD/BCF (pH 5.5): 1008.96
ACD/KOC (pH 5.5): 4917.84
ACD/LogD (pH 7.4): 4.26
ACD/BCF (pH 7.4): 1008.96
ACD/KOC (pH 7.4): 4917.84
Polar Surface Area: 0 Å2
Polarizability: 17.2±0.5 10-24cm3
Surface Tension: 21.9±3.0 dyne/cm
Molar Volume: 172.4±3.0 cm3

Click to predict properties on the Chemicalize site


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