ChemSpider 2D Image | (5Z,7S,10R)-7,10-Dihydroxy-5-tetradecen-8-ynoic acid | C14H22O4

(5Z,7S,10R)-7,10-Dihydroxy-5-tetradecen-8-ynoic acid

  • Molecular FormulaC14H22O4
  • Average mass254.322 Da
  • Monoisotopic mass254.151810 Da
  • ChemSpider ID28284927

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(5Z,7S,10R)-7,10-Dihydroxy-5-tetradecen-8-insäure [German] [ACD/IUPAC Name]
(5Z,7S,10R)-7,10-Dihydroxy-5-tetradecen-8-ynoic acid [ACD/IUPAC Name]
5-Tetradecen-8-ynoic acid, 7,10-dihydroxy-, (5Z,7S,10R)- [ACD/Index Name]
Acide (5Z,7S,10R)-7,10-dihydroxy-5-tétradécén-8-ynoïque [French] [ACD/IUPAC Name]
gallicynoic acid A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 443.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±6.0 kJ/mol
Flash Point: 235.9±25.2 °C
Index of Refraction: 1.525
Molar Refractivity: 69.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.81
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.17
ACD/KOC (pH 5.5): 22.27
ACD/LogD (pH 7.4): -1.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 78 Å2
Polarizability: 27.6±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 226.9±3.0 cm3

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