ChemSpider 2D Image | (5s,7s)-2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decane | C19H28N2

(5s,7s)-2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decane

  • Molecular FormulaC19H28N2
  • Average mass284.439 Da
  • Monoisotopic mass284.225250 Da
  • ChemSpider ID23718240

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(5s,7s)-2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decan [German] [ACD/IUPAC Name]
(5s,7s)-2-(4-Isopropylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.13,7]decane [ACD/IUPAC Name]
(5s,7s)-2-(4-Isopropylphényl)-5,7-diméthyl-1,3-diazatricyclo[3.3.1.13,7]décane [French] [ACD/IUPAC Name]
1,3-Diazatricyclo[3.3.1.13,7]decane, 5,7-dimethyl-2-[4-(1-methylethyl)phenyl]- [ACD/Index Name]
889809-05-6 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 355.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.1±3.0 kJ/mol
Flash Point: 153.4±12.4 °C
Index of Refraction: 1.593
Molar Refractivity: 88.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 26.55
ACD/KOC (pH 5.5): 143.00
ACD/LogD (pH 7.4): 3.93
ACD/BCF (pH 7.4): 533.33
ACD/KOC (pH 7.4): 2872.98
Polar Surface Area: 6 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 44.7±5.0 dyne/cm
Molar Volume: 261.2±5.0 cm3

Click to predict properties on the Chemicalize site


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