ChemSpider 2D Image | 4-[(1Z)-1-Hydroxy-3-(3-hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)-3-oxo-1-propen-1-yl]benzoic acid | C24H26O5

4-[(1Z)-1-Hydroxy-3-(3-hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)-3-oxo-1-propen-1-yl]benzoic acid

  • Molecular FormulaC24H26O5
  • Average mass394.460 Da
  • Monoisotopic mass394.178009 Da
  • ChemSpider ID107562278

More details:

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

4-[(1Z)-1-Hydroxy-3-(3-hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)-3-oxo-1-propen-1-yl]benzoic acid [ACD/IUPAC Name]
4-[(1Z)-1-Hydroxy-3-(3-hydroxy-5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalinyl)-3-oxo-1-propen-1-yl]benzoesäure [German] [ACD/IUPAC Name]
Acide 4-[(1Z)-1-hydroxy-3-(3-hydroxy-5,5,8,8-tétraméthyl-5,6,7,8-tétrahydro-2-naphtalényl)-3-oxo-1-propén-1-yl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(1Z)-1-hydroxy-3-oxo-3-(5,6,7,8-tetrahydro-3-hydroxy-5,5,8,8-tetramethyl-2-naphthalenyl)-1-propen-1-yl]- [ACD/Index Name]
4-[1-Hydroxy-3-(3-hydroxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-3-oxoprop-1-enyl]benzoic acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 613.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 338.9±28.0 °C
Index of Refraction: 1.602
Molar Refractivity: 111.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.96
ACD/LogD (pH 5.5): 4.51
ACD/BCF (pH 5.5): 787.27
ACD/KOC (pH 5.5): 1806.90
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 14.43
ACD/KOC (pH 7.4): 33.11
Polar Surface Area: 95 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 53.0±3.0 dyne/cm
Molar Volume: 325.3±3.0 cm3

Click to predict properties on the Chemicalize site


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