ChemSpider 2D Image | (1S,3Z,7E,11S,12S)-4-(Hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,7-dien-12-ol | C20H34O2

(1S,3Z,7E,11S,12S)-4-(Hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,7-dien-12-ol

  • Molecular FormulaC20H34O2
  • Average mass306.483 Da
  • Monoisotopic mass306.255890 Da
  • ChemSpider ID24534771

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1S,3Z,7E,11S,12S)-4-(Hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,7-dien-12-ol [ACD/IUPAC Name]
(1S,3Z,7E,11S,12S)-4-(Hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,7-dien-12-ol [German] [ACD/IUPAC Name]
(1S,3Z,7E,11S,12S)-4-(Hydroxyméthyl)-8,12,15,15-tétraméthylbicyclo[9.3.1]pentadéca-3,7-dién-12-ol [French] [ACD/IUPAC Name]
Bicyclo[9.3.1]pentadeca-3,7-diene-4-methanol, 12-hydroxy-8,12,15,15-tetramethyl-, (1S,3Z,7E,11S,12S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 431.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 79.3±6.0 kJ/mol
Flash Point: 188.8±23.3 °C
Index of Refraction: 1.489
Molar Refractivity: 92.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 5.48
ACD/BCF (pH 5.5): 8551.29
ACD/KOC (pH 5.5): 22705.88
ACD/LogD (pH 7.4): 5.48
ACD/BCF (pH 7.4): 8551.29
ACD/KOC (pH 7.4): 22705.88
Polar Surface Area: 40 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 31.4±3.0 dyne/cm
Molar Volume: 322.1±3.0 cm3

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