ChemSpider 2D Image | (4R)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-4-isoquinolinol | C16H17NO

(4R)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-4-isoquinolinol

  • Molecular FormulaC16H17NO
  • Average mass239.312 Da
  • Monoisotopic mass239.131012 Da
  • ChemSpider ID23165071
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(4R)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-4-isochinolinol [German] [ACD/IUPAC Name]
(4R)-2-Méthyl-4-phényl-1,2,3,4-tétrahydro-4-isoquinoléinol [French] [ACD/IUPAC Name]
(4R)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-4-isoquinolinol [ACD/IUPAC Name]
4-Isoquinolinol, 1,2,3,4-tetrahydro-2-methyl-4-phenyl-, (4R)- [ACD/Index Name]
(4R)-2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-4-ol
2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-4-ol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 377.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 130.2±18.7 °C
Index of Refraction: 1.620
Molar Refractivity: 72.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.48
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 23.14
ACD/KOC (pH 7.4): 263.76
Polar Surface Area: 23 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 206.9±3.0 cm3

Click to predict properties on the Chemicalize site






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