Found 1 result

Search term: 78440560 (Found by CSID)
ChemSpider 2D Image | (4aR,6aR,8R,10S,10aS,10bR)-10-Hydroxy-4a,8,10b-trimethyl-2,3,4a,6a,7,8,9,10,10a,10b-decahydro-1H-benzo[f]chromen-1-one | C16H24O3

(4aR,6aR,8R,10S,10aS,10bR)-10-Hydroxy-4a,8,10b-trimethyl-2,3,4a,6a,7,8,9,10,10a,10b-decahydro-1H-benzo[f]chromen-1-one

  • Molecular FormulaC16H24O3
  • Average mass264.360 Da
  • Monoisotopic mass264.172546 Da
  • ChemSpider ID78440560

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(4aR,6aR,8R,10S,10aS,10bR)-10-Hydroxy-4a,8,10b-trimethyl-2,3,4a,6a,7,8,9,10,10a,10b-decahydro-1H-benzo[f]chromen-1-on [German] [ACD/IUPAC Name]
(4aR,6aR,8R,10S,10aS,10bR)-10-Hydroxy-4a,8,10b-trimethyl-2,3,4a,6a,7,8,9,10,10a,10b-decahydro-1H-benzo[f]chromen-1-one [ACD/IUPAC Name]
(4aR,6aR,8R,10S,10aS,10bR)-10-Hydroxy-4a,8,10b-triméthyl-2,3,4a,6a,7,8,9,10,10a,10b-décahydro-1H-benzo[f]chromén-1-one [French] [ACD/IUPAC Name]
1H-Naphtho[2,1-b]pyran-1-one, 2,3,4a,6a,7,8,9,10,10a,10b-decahydro-10-hydroxy-4a,8,10b-trimethyl-, (4aR,6aR,8R,10S,10aS,10bR)- [ACD/Index Name]
Isoversiol A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 382.0±42.0 °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: 135.6±21.4 °C
Index of Refraction: 1.526
Molar Refractivity: 72.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.23
ACD/KOC (pH 5.5): 389.82
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.23
ACD/KOC (pH 7.4): 389.82
Polar Surface Area: 47 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 237.7±3.0 cm3

Click to predict properties on the Chemicalize site


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