Found 20 results

Search term: C25H42O9 (Found by molecular formula)
ChemSpider 2D Image | (2R)-3-Acetoxy-2-hydroxypropyl (5Z,9beta,13E,15S)-9,11,15-trihydroxythromboxa-5,13-dien-1-oate | C25H42O9

(2R)-3-Acetoxy-2-hydroxypropyl (5Z,9β,13E,15S)-9,11,15-trihydroxythromboxa-5,13-dien-1-oate

  • Molecular FormulaC25H42O9
  • Average mass486.596 Da
  • Monoisotopic mass486.282898 Da
  • ChemSpider ID117216136

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(2R)-3-Acetoxy-2-hydroxypropyl (5Z,9β,13E,15S)-9,11,15-trihydroxythromboxa-5,13-dien-1-oate [ACD/IUPAC Name]
(2R)-3-Acetoxy-2-hydroxypropyl-(5Z,9β,13E,15S)-9,11,15-trihydroxythromboxa-5,13-dien-1-oat [German] [ACD/IUPAC Name]
(5Z,9β,13E,15S)-9,11,15-Trihydroxythromboxa-5,13-dién-1-oate de (2R)-3-acétoxy-2-hydroxypropyle [French] [ACD/IUPAC Name]
D-erythro-Pentopyranose, 4-[(2Z)-7-[(2R)-3-(acetyloxy)-2-hydroxypropoxy]-7-oxo-2-hepten-1-yl]-2,4-dideoxy-5-C-[(1E,3S)-3-hydroxy-1-octen-1-yl]-, (5R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 648.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 109.5±6.0 kJ/mol
Flash Point: 208.8±25.0 °C
Index of Refraction: 1.544
Molar Refractivity: 129.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 0
ACD/LogP: 1.93
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.34
ACD/KOC (pH 5.5): 268.25
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.34
ACD/KOC (pH 7.4): 268.25
Polar Surface Area: 143 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 408.9±3.0 cm3

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