ChemSpider 2D Image | MFCD03936148 | C7H14

MFCD03936148

  • Molecular FormulaC7H14
  • Average mass98.186 Da
  • Monoisotopic mass98.109550 Da
  • ChemSpider ID22890411
  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(2E,4R)-4-Methyl-2-hexen [German] [ACD/IUPAC Name]
(2E,4R)-4-Methyl-2-hexene [ACD/IUPAC Name]
(2E,4R)-4-Méthyl-2-hexène [French] [ACD/IUPAC Name]
2-Hexene, 4-methyl-, (2E,4R)- [ACD/Index Name]
MFCD03936148
trans-4-Methyl-2-hexene

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.7±0.1 g/cm3
Boiling Point: 88.4±7.0 °C at 760 mmHg
Vapour Pressure: 69.0±0.1 mmHg at 25°C
Enthalpy of Vaporization: 31.5±0.8 kJ/mol
Flash Point: -5.1±9.2 °C
Index of Refraction: 1.414
Molar Refractivity: 34.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 190.90
ACD/KOC (pH 5.5): 1493.52
ACD/LogD (pH 7.4): 3.30
ACD/BCF (pH 7.4): 190.90
ACD/KOC (pH 7.4): 1493.52
Polar Surface Area: 0 Å2
Polarizability: 13.7±0.5 10-24cm3
Surface Tension: 20.9±3.0 dyne/cm
Molar Volume: 138.1±3.0 cm3

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