ChemSpider 2D Image | N-[(Methylsulfanyl)methyl]benzamide | C9H11NOS

N-[(Methylsulfanyl)methyl]benzamide

  • Molecular FormulaC9H11NOS
  • Average mass181.255 Da
  • Monoisotopic mass181.056137 Da
  • ChemSpider ID15875714

More details:

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

Benzamide, N-[(methylthio)methyl]- [ACD/Index Name]
N-[(Methylsulfanyl)methyl]benzamid [German] [ACD/IUPAC Name]
N-[(Methylsulfanyl)methyl]benzamide [ACD/IUPAC Name]
N-[(Méthylsulfanyl)méthyl]benzamide [French] [ACD/IUPAC Name]
57152-27-9 [RN]
MFCD24622851

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

Density: 1.1±0.1 g/cm3
Boiling Point: 365.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.2±3.0 kJ/mol
Flash Point: 175.0±23.2 °C
Index of Refraction: 1.569
Molar Refractivity: 52.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.50
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 8.06
ACD/KOC (pH 5.5): 154.95
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 8.06
ACD/KOC (pH 7.4): 154.95
Polar Surface Area: 54 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 160.3±3.0 cm3

Click to predict properties on the Chemicalize site


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