ChemSpider 2D Image | (5S,7R,8S)-5-Isopropenyl-3,7,8-trimethyl-5,6,7,8-tetrahydro-2-naphthalenol | C16H22O

(5S,7R,8S)-5-Isopropenyl-3,7,8-trimethyl-5,6,7,8-tetrahydro-2-naphthalenol

  • Molecular FormulaC16H22O
  • Average mass230.345 Da
  • Monoisotopic mass230.167068 Da
  • ChemSpider ID34554379

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5S,7R,8S)-5-Isopropényl-3,7,8-triméthyl-5,6,7,8-tétrahydro-2-naphtalénol [French] [ACD/IUPAC Name]
(5S,7R,8S)-5-Isopropenyl-3,7,8-trimethyl-5,6,7,8-tetrahydro-2-naphthalenol [ACD/IUPAC Name]
(5S,7R,8S)-5-Isopropenyl-3,7,8-trimethyl-5,6,7,8-tetrahydro-2-naphthalinol [German] [ACD/IUPAC Name]
2-Naphthalenol, 5,6,7,8-tetrahydro-3,7,8-trimethyl-5-(1-methylethenyl)-, (5S,7R,8S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 340.7±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.7±3.0 kJ/mol
Flash Point: 153.5±17.3 °C
Index of Refraction: 1.526
Molar Refractivity: 72.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 1
ACD/LogP: 5.73
ACD/LogD (pH 5.5): 5.20
ACD/BCF (pH 5.5): 5248.80
ACD/KOC (pH 5.5): 16010.73
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5246.41
ACD/KOC (pH 7.4): 16003.42
Polar Surface Area: 20 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 32.8±3.0 dyne/cm
Molar Volume: 236.5±3.0 cm3

Click to predict properties on the Chemicalize site


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