ChemSpider 2D Image | 1-[4-(Ethylsulfanyl)phenyl]-N-hydroxy-N-methyl-2-propanamine | C12H19NOS

1-[4-(Ethylsulfanyl)phenyl]-N-hydroxy-N-methyl-2-propanamine

  • Molecular FormulaC12H19NOS
  • Average mass225.350 Da
  • Monoisotopic mass225.118729 Da
  • ChemSpider ID24677235

More details:

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

1-[4-(Ethylsulfanyl)phenyl]-N-hydroxy-N-methyl-2-propanamin [German] [ACD/IUPAC Name]
1-[4-(Ethylsulfanyl)phenyl]-N-hydroxy-N-methyl-2-propanamine [ACD/IUPAC Name]
1-[4-(Éthylsulfanyl)phényl]-N-hydroxy-N-méthyl-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 4-(ethylthio)-N-hydroxy-N,α-dimethyl- [ACD/Index Name]
1204749-29-0 [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: 361.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 172.6±25.9 °C
Index of Refraction: 1.570
Molar Refractivity: 67.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.41
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 39.13
ACD/KOC (pH 5.5): 436.54
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 54.49
ACD/KOC (pH 7.4): 607.93
Polar Surface Area: 49 Å2
Polarizability: 26.9±0.5 10-24cm3
Surface Tension: 44.9±5.0 dyne/cm
Molar Volume: 207.0±5.0 cm3

Click to predict properties on the Chemicalize site


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