ChemSpider 2D Image | (6beta,7alpha)-6,12-Dihydroxy-11,14-dioxoabieta-8,12-dien-7-yl formate | C21H28O6

(6β,7α)-6,12-Dihydroxy-11,14-dioxoabieta-8,12-dien-7-yl formate

  • Molecular FormulaC21H28O6
  • Average mass376.443 Da
  • Monoisotopic mass376.188599 Da
  • ChemSpider ID20018024
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(6β,7α)-6,12-Dihydroxy-11,14-dioxoabieta-8,12-dien-7-yl formate [ACD/IUPAC Name]
(6β,7α)-6,12-Dihydroxy-11,14-dioxoabieta-8,12-dien-7-ylformiat [German] [ACD/IUPAC Name]
1,4-Phenanthrenedione, 10-(formyloxy)-4b,5,6,7,8,8a,9,10-octahydro-3,9-dihydroxy-4b,8,8-trimethyl-2-(1-methylethyl)-, (4bS,8aS,9S,10S)- [ACD/Index Name]
Formiate de (6β,7α)-6,12-dihydroxy-11,14-dioxoabiéta-8,12-dién-7-yle [French] [ACD/IUPAC Name]
65714-77-4 [RN]
7[α]-Formyloxy-6[β],12-dihydroxy-abieta-8,12-diene-11,14-dione

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.0 g/cm3
Boiling Point: 511.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 90.0±0.0 kJ/mol
Flash Point: 174.2±0.0 °C
Index of Refraction:
Molar Refractivity: 97.4±0.0 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 31.78
ACD/KOC (pH 5.5): 204.56
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.57
Polar Surface Area: 101 Å2
Polarizability: 38.6±0.0 10-24cm3
Surface Tension: 52.0±0.0 dyne/cm
Molar Volume: 298.4±0.0 cm3

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