ChemSpider 2D Image | (2E,4R)-4-Methyl-2-phenyl-2-hexenal | C13H16O

(2E,4R)-4-Methyl-2-phenyl-2-hexenal

  • Molecular FormulaC13H16O
  • Average mass188.266 Da
  • Monoisotopic mass188.120117 Da
  • ChemSpider ID34989343

  • 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-phenyl-2-hexenal [German] [ACD/IUPAC Name]
(2E,4R)-4-Methyl-2-phenyl-2-hexenal [ACD/IUPAC Name]
(2E,4R)-4-Méthyl-2-phényl-2-hexénal [French] [ACD/IUPAC Name]
Benzeneacetaldehyde, α-[(2R)-2-methylbutylidene]-, (αE)- [ACD/Index Name]
26643-92-5 [RN]
4-Methyl-2-phenyl-2-hexenal [ACD/IUPAC Name]
UNII-BA0G19BTR6

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

Density: 1.0±0.1 g/cm3
Boiling Point: 310.8±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.2±3.0 kJ/mol
Flash Point: 123.8±14.9 °C
Index of Refraction: 1.514
Molar Refractivity: 59.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.21
ACD/BCF (pH 5.5): 161.84
ACD/KOC (pH 5.5): 1327.00
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 161.84
ACD/KOC (pH 7.4): 1327.00
Polar Surface Area: 17 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 197.5±3.0 cm3

Click to predict properties on the Chemicalize site


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