Found 2 results

Search term: BUZKSRWFBUELQO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (9Z,12Z,15Z)-13-Hydroperoxy-9,12,15-octadecatrienoic acid | C18H30O4

(9Z,12Z,15Z)-13-Hydroperoxy-9,12,15-octadecatrienoic acid

  • Molecular FormulaC18H30O4
  • Average mass310.428 Da
  • Monoisotopic mass310.214417 Da
  • ChemSpider ID66737551

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z,12Z,15Z)-13-Hydroperoxy-9,12,15-octadecatrienoic acid [ACD/IUPAC Name]
(9Z,12Z,15Z)-13-Hydroperoxy-9,12,15-octadecatriensäure [German] [ACD/IUPAC Name]
9,12,15-Octadecatrienoic acid, 13-hydroperoxy-, (9Z,12Z,15Z)- [ACD/Index Name]
Acide (9Z,12Z,15Z)-13-hydroperoxy-9,12,15-octadécatriénoïque [French] [ACD/IUPAC Name]
13-hydroperoxylinolenic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 462.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.4±6.0 kJ/mol
Flash Point: 157.2±22.2 °C
Index of Refraction: 1.504
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 6.28
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 1440.63
ACD/KOC (pH 5.5): 3763.82
ACD/LogD (pH 7.4): 2.92
ACD/BCF (pH 7.4): 23.09
ACD/KOC (pH 7.4): 60.34
Polar Surface Area: 67 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 304.8±3.0 cm3

Click to predict properties on the Chemicalize site


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