ChemSpider 2D Image | 1-(2-Methylbenzyl)-3,4-dihydroisoquinoline | C17H17N

1-(2-Methylbenzyl)-3,4-dihydroisoquinoline

  • Molecular FormulaC17H17N
  • Average mass235.324 Da
  • Monoisotopic mass235.136093 Da
  • ChemSpider ID32058720

More details:

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

1-(2-Methylbenzyl)-3,4-dihydroisochinolin [German] [ACD/IUPAC Name]
1-(2-Méthylbenzyl)-3,4-dihydroisoquinoléine [French] [ACD/IUPAC Name]
1-(2-Methylbenzyl)-3,4-dihydroisoquinoline [ACD/IUPAC Name]
104330-69-0 [RN]
Isoquinoline, 3,4-dihydro-1-[(2-methylphenyl)methyl]- [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: 378.0±42.0 °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: 174.8±28.7 °C
Index of Refraction: 1.593
Molar Refractivity: 76.1±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 204.84
ACD/KOC (pH 5.5): 969.74
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1055.89
ACD/KOC (pH 7.4): 4998.75
Polar Surface Area: 12 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 38.3±7.0 dyne/cm
Molar Volume: 224.6±7.0 cm3

Click to predict properties on the Chemicalize site


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