ChemSpider 2D Image | N-Hydroxy-1-[4-(methylsulfanyl)phenyl]-2-butanamine | C11H17NOS

N-Hydroxy-1-[4-(methylsulfanyl)phenyl]-2-butanamine

  • Molecular FormulaC11H17NOS
  • Average mass211.324 Da
  • Monoisotopic mass211.103088 Da
  • ChemSpider ID24654162

More details:

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

Benzeneethanamine, α-ethyl-N-hydroxy-4-(methylthio)- [ACD/Index Name]
N-Hydroxy-1-[4-(methylsulfanyl)phenyl]-2-butanamin [German] [ACD/IUPAC Name]
N-Hydroxy-1-[4-(methylsulfanyl)phenyl]-2-butanamine [ACD/IUPAC Name]
N-Hydroxy-1-[4-(méthylsulfanyl)phényl]-2-butanamine [French] [ACD/IUPAC Name]
1204749-75-6 [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: 363.6±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.3±3.0 kJ/mol
Flash Point: 173.7±30.7 °C
Index of Refraction: 1.571
Molar Refractivity: 63.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 13.06
ACD/KOC (pH 5.5): 156.24
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 41.65
ACD/KOC (pH 7.4): 498.27
Polar Surface Area: 58 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 45.3±5.0 dyne/cm
Molar Volume: 191.8±5.0 cm3

Click to predict properties on the Chemicalize site


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