ChemSpider 2D Image | calostomal | C16H16O3

calostomal

  • Molecular FormulaC16H16O3
  • Average mass256.296 Da
  • Monoisotopic mass256.109955 Da
  • ChemSpider ID28283879
  • Double-bond stereo - Double-bond stereo


More details:



Featured data source



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

(2E,4E,6E,8E,10E,12E,14E)-16-Oxo-2,4,6,8,10,12,14-hexadecaheptaenoic acid [ACD/IUPAC Name]
(2E,4E,6E,8E,10E,12E,14E)-16-Oxo-2,4,6,8,10,12,14-hexadecaheptaensäure [German] [ACD/IUPAC Name]
2,4,6,8,10,12,14-Hexadecaheptaenoic acid, 16-oxo-, (2E,4E,6E,8E,10E,12E,14E)- [ACD/Index Name]
Acide (2E,4E,6E,8E,10E,12E,14E)-16-oxo-2,4,6,8,10,12,14-hexadécaheptaénoïque [French] [ACD/IUPAC Name]
calostomal [Wiki]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 514.2±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 86.0±6.0 kJ/mol
Flash Point: 278.9±19.1 °C
Index of Refraction: 1.567
Molar Refractivity: 78.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.22
ACD/LogD (pH 5.5): 1.17
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 28.24
ACD/LogD (pH 7.4): -0.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 239.9±3.0 cm3

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