ChemSpider 2D Image | 5-(3-Hydroxy-3-methyl-pent-4-enyl)-1,5,6-trimethyl-1,2,3,5,6,7,8,8a-octahydro-naphthalene-1-carboxylic acid | C20H32O3

5-(3-Hydroxy-3-methyl-pent-4-enyl)-1,5,6-trimethyl-1,2,3,5,6,7,8,8a-octahydro-naphthalene-1-carboxylic acid

  • Molecular FormulaC20H32O3
  • Average mass320.466 Da
  • Monoisotopic mass320.235138 Da
  • ChemSpider ID20057606

More details:

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

1-Naphthalenecarboxylic acid, 1,2,3,5,6,7,8,8a-octahydro-5-(3-hydroxy-3-methyl-4-penten-1-yl)-1,5,6-trimethyl- [ACD/Index Name]
5-(3-Hydroxy-3-methyl-4-penten-1-yl)-1,5,6-trimethyl-1,2,3,5,6,7,8,8a-octahydro-1-naphthalenecarboxylic acid [ACD/IUPAC Name]
5-(3-Hydroxy-3-methyl-4-penten-1-yl)-1,5,6-trimethyl-1,2,3,5,6,7,8,8a-octahydro-1-naphthalincarbonsäure [German] [ACD/IUPAC Name]
5-(3-Hydroxy-3-methyl-pent-4-enyl)-1,5,6-trimethyl-1,2,3,5,6,7,8,8a-octahydro-naphthalene-1-carboxylic acid
Acide 5-(3-hydroxy-3-méthyl-4-pentén-1-yl)-1,5,6-triméthyl-1,2,3,5,6,7,8,8a-octahydro-1-naphtalènecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 452.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±6.0 kJ/mol
Flash Point: 241.8±21.9 °C
Index of Refraction: 1.528
Molar Refractivity: 93.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.27
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 539.32
ACD/KOC (pH 5.5): 1780.55
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 8.53
ACD/KOC (pH 7.4): 28.18
Polar Surface Area: 58 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 41.7±5.0 dyne/cm
Molar Volume: 302.6±5.0 cm3

Click to predict properties on the Chemicalize site


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