ChemSpider 2D Image | 2-[4-(sec-Butylsulfanyl)-2,5-dimethoxyphenyl]-N-hydroxyethanamine | C14H23NO3S

2-[4-(sec-Butylsulfanyl)-2,5-dimethoxyphenyl]-N-hydroxyethanamine

  • Molecular FormulaC14H23NO3S
  • Average mass285.402 Da
  • Monoisotopic mass285.139862 Da
  • ChemSpider ID21106319

More details:






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

2-[4-(butan-2-ylsulfanyl)-2,5-dimethoxyphenyl]-N-hydroxyethanamine
2-[4-(sec-Butylsulfanyl)-2,5-dimethoxyphenyl]-N-hydroxyethanamin [German] [ACD/IUPAC Name]
2-[4-(sec-Butylsulfanyl)-2,5-dimethoxyphenyl]-N-hydroxyethanamine [ACD/IUPAC Name]
2-[4-(sec-Butylsulfanyl)-2,5-diméthoxyphényl]-N-hydroxyéthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, N-hydroxy-2,5-dimethoxy-4-[(1-methylpropyl)thio]- [ACD/Index Name]
N-[2-(4-sec-Butylsulfanyl-2,5-dimethoxy-phenyl)-ethyl]-hydroxylamine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 435.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 216.9±31.5 °C
Index of Refraction: 1.551
Molar Refractivity: 80.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 67.89
ACD/KOC (pH 5.5): 610.76
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 115.71
ACD/KOC (pH 7.4): 1041.04
Polar Surface Area: 76 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 45.5±5.0 dyne/cm
Molar Volume: 252.3±5.0 cm3

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