ChemSpider 2D Image | 4-Methoxy-N-[3-(methylsulfanyl)propyl]-2-butanamine | C9H21NOS

4-Methoxy-N-[3-(methylsulfanyl)propyl]-2-butanamine

  • Molecular FormulaC9H21NOS
  • Average mass191.334 Da
  • Monoisotopic mass191.134384 Da
  • ChemSpider ID44592280

More details:

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

2-Butanamine, 4-methoxy-N-[3-(methylthio)propyl]- [ACD/Index Name]
4-Methoxy-N-[3-(methylsulfanyl)propyl]-2-butanamin [German] [ACD/IUPAC Name]
4-Methoxy-N-[3-(methylsulfanyl)propyl]-2-butanamine [ACD/IUPAC Name]
4-Méthoxy-N-[3-(méthylsulfanyl)propyl]-2-butanamine [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 267.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.5±3.0 kJ/mol
Flash Point: 115.4±23.2 °C
Index of Refraction: 1.464
Molar Refractivity: 57.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.83
ACD/LogD (pH 5.5): -1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 47 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 30.6±3.0 dyne/cm
Molar Volume: 206.6±3.0 cm3

Click to predict properties on the Chemicalize site


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