ChemSpider 2D Image | 1-Cyclopropyl-N-[4-(methylsulfanyl)benzyl]-1-phenylmethanamine | C18H21NS

1-Cyclopropyl-N-[4-(methylsulfanyl)benzyl]-1-phenylmethanamine

  • Molecular FormulaC18H21NS
  • Average mass283.431 Da
  • Monoisotopic mass283.139465 Da
  • ChemSpider ID37947907

More details:

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

1-Cyclopropyl-N-[4-(methylsulfanyl)benzyl]-1-phenylmethanamin [German] [ACD/IUPAC Name]
1-Cyclopropyl-N-[4-(methylsulfanyl)benzyl]-1-phenylmethanamine [ACD/IUPAC Name]
1-Cyclopropyl-N-[4-(méthylsulfanyl)benzyl]-1-phénylméthanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, α-cyclopropyl-N-[[4-(methylthio)phenyl]methyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 412.6±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 203.3±25.4 °C
Index of Refraction: 1.622
Molar Refractivity: 88.8±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 1.30
ACD/BCF (pH 5.5): 1.15
ACD/KOC (pH 5.5): 5.74
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 32.13
ACD/KOC (pH 7.4): 159.90
Polar Surface Area: 37 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 252.2±5.0 cm3

Click to predict properties on the Chemicalize site


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