ChemSpider 2D Image | (2Z)-7-Phenyl-2-heptene-4,6-diynal | C13H8O

(2Z)-7-Phenyl-2-heptene-4,6-diynal

  • Molecular FormulaC13H8O
  • Average mass180.202 Da
  • Monoisotopic mass180.057510 Da
  • ChemSpider ID61839932

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-7-Phenyl-2-hepten-4,6-diinal [German] [ACD/IUPAC Name]
(2Z)-7-Phenyl-2-heptene-4,6-diynal [ACD/IUPAC Name]
(2Z)-7-Phényl-2-heptène-4,6-diynal [French] [ACD/IUPAC Name]
2-Heptene-4,6-diynal, 7-phenyl-, (2Z)- [ACD/Index Name]
1379654-87-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 326.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 141.2±20.6 °C
Index of Refraction: 1.599
Molar Refractivity: 55.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.10
ACD/LogD (pH 5.5): 3.10
ACD/BCF (pH 5.5): 133.63
ACD/KOC (pH 5.5): 1157.02
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 133.63
ACD/KOC (pH 7.4): 1157.02
Polar Surface Area: 17 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 51.7±5.0 dyne/cm
Molar Volume: 162.3±5.0 cm3

Click to predict properties on the Chemicalize site


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