ChemSpider 2D Image | (6S)-6-[4-(2-Methylphenyl)-1-piperazinyl]-5,6,7,8-tetrahydro-2-naphthalenol | C21H26N2O

(6S)-6-[4-(2-Methylphenyl)-1-piperazinyl]-5,6,7,8-tetrahydro-2-naphthalenol

  • Molecular FormulaC21H26N2O
  • Average mass322.444 Da
  • Monoisotopic mass322.204498 Da
  • ChemSpider ID32809568
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(6S)-6-[4-(2-Méthylphényl)-1-pipérazinyl]-5,6,7,8-tétrahydro-2-naphtalénol [French] [ACD/IUPAC Name]
(6S)-6-[4-(2-Methylphenyl)-1-piperazinyl]-5,6,7,8-tetrahydro-2-naphthalenol [ACD/IUPAC Name]
(6S)-6-[4-(2-Methylphenyl)-1-piperazinyl]-5,6,7,8-tetrahydro-2-naphthalinol [German] [ACD/IUPAC Name]
2-Naphthalenol, 5,6,7,8-tetrahydro-6-[4-(2-methylphenyl)-1-piperazinyl]-, (6S)- [ACD/Index Name]
70312-00-4 [RN]
Tolnapersine [INN]
UNII-72MZZ4V9KL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 505.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.4±3.0 kJ/mol
Flash Point: 263.1±28.8 °C
Index of Refraction: 1.623
Molar Refractivity: 97.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 9.77
ACD/KOC (pH 5.5): 58.52
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 288.32
ACD/KOC (pH 7.4): 1727.80
Polar Surface Area: 27 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 277.4±3.0 cm3

Click to predict properties on the Chemicalize site






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