ChemSpider 2D Image | 9beta-pimara-7,15-dien-19-ol | C20H32O

9β-pimara-7,15-dien-19-ol

  • Molecular FormulaC20H32O
  • Average mass288.467 Da
  • Monoisotopic mass288.245331 Da
  • ChemSpider ID26606373

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(9β)-Pimara-7,15-dien-19-ol [German] [ACD/IUPAC Name]
(9β)-Pimara-7,15-dien-19-ol [ACD/IUPAC Name]
(9β)-Pimara-7,15-dién-19-ol [French] [ACD/IUPAC Name]
1-Phenanthrenemethanol, 7-ethenyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydro-1,4a,7-trimethyl-, (1S,4aR,4bR,7R,10aR)- [ACD/Index Name]
9β-pimara-7,15-dien-19-ol
(-)-9&β
(-)-9&β;-pimara-7,15-dien-19-ol
[(1S,4aR,4bR,7R,10aR)-7-ethenyl-1,4a,7-trimethyl-1,2,3,4,4a,4b,5,6,7,8,10,10a-dodecahydrophenanthren-1-yl]methanol
-pimara-7,15-dien-19-ol

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

CHEBI:63656 [DBID]
  • Miscellaneous

    • Chemical Class:

      A pimarane diterpenoid that is pimarane which has been dehyrogenated to introduce double bonds at positions 7-8 and 15-16, which has a <stereo>beta</stereo>-hydrogen in place of an <stereo>alpha</ster eo>-hydrogen at position 9, and in which one of the hydrogens of the <stereo>beta</stereo>-methyl group at position 4 has been replaced by a hydroxy group. ChEBI CHEBI:63656
      A pimarane diterpenoid that is pimarane which has been dehyrogenated to introduce double bonds at positions 7-8 and 15-16, which has a beta-hydrogen in place of an alpha-hydrogen at position 9, and in which one of the hydrogens of the beta-methyl group at position 4 has been replaced by a hydroxy group. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:63656, CHEBI:63656

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

Density: 1.0±0.1 g/cm3
Boiling Point: 382.1±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 72.9±6.0 kJ/mol
Flash Point: 130.2±15.6 °C
Index of Refraction: 1.530
Molar Refractivity: 89.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.60
ACD/LogD (pH 5.5): 6.19
ACD/BCF (pH 5.5): 29802.60
ACD/KOC (pH 5.5): 55495.21
ACD/LogD (pH 7.4): 6.19
ACD/BCF (pH 7.4): 29802.60
ACD/KOC (pH 7.4): 55495.21
Polar Surface Area: 20 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 37.7±5.0 dyne/cm
Molar Volume: 289.5±5.0 cm3

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