ChemSpider 2D Image | 2-{Methyl[4-(methylsulfanyl)benzyl]amino}ethanol | C11H17NOS

2-{Methyl[4-(methylsulfanyl)benzyl]amino}ethanol

  • Molecular FormulaC11H17NOS
  • Average mass211.324 Da
  • Monoisotopic mass211.103088 Da
  • ChemSpider ID28301640

More details:

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

2-{Methyl[4-(methylsulfanyl)benzyl]amino}ethanol [German] [ACD/IUPAC Name]
2-{Methyl[4-(methylsulfanyl)benzyl]amino}ethanol [ACD/IUPAC Name]
2-{Méthyl[4-(méthylsulfanyl)benzyl]amino}éthanol [French] [ACD/IUPAC Name]
Ethanol, 2-[methyl[[4-(methylthio)phenyl]methyl]amino]- [ACD/Index Name]
1249248-47-2 [RN]
2-(Methyl(4-(methylthio)benzyl)amino)ethanol
2-[METHYL({[4-(METHYLSULFANYL)PHENYL]METHYL})AMINO]ETHAN-1-OL
2-[METHYL({[4-(METHYLSULFANYL)PHENYL]METHYL})AMINO]ETHANOL
2-[methyl-(4-methylsulfanylbenzyl)amino]ethanol
2-[Methyl-(4-methylsulfanyl-benzyl)-amino]-ethanol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 330.5±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 153.7±23.7 °C
Index of Refraction: 1.581
Molar Refractivity: 63.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -0.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.11
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 3.70
ACD/KOC (pH 7.4): 56.83
Polar Surface Area: 49 Å2
Polarizability: 25.1±0.5 10-24cm3
Surface Tension: 47.1±5.0 dyne/cm
Molar Volume: 190.0±5.0 cm3

Click to predict properties on the Chemicalize site


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