ChemSpider 2D Image | N-(2,4-Dichlorobenzyl)-3-(methylsulfanyl)aniline | C14H13Cl2NS

N-(2,4-Dichlorobenzyl)-3-(methylsulfanyl)aniline

  • Molecular FormulaC14H13Cl2NS
  • Average mass298.231 Da
  • Monoisotopic mass297.014587 Da
  • ChemSpider ID24282226

More details:

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

Benzenemethanamine, 2,4-dichloro-N-[3-(methylthio)phenyl]- [ACD/Index Name]
N-(2,4-Dichlorbenzyl)-3-(methylsulfanyl)anilin [German] [ACD/IUPAC Name]
N-(2,4-Dichlorobenzyl)-3-(methylsulfanyl)aniline [ACD/IUPAC Name]
N-(2,4-Dichlorobenzyl)-3-(méthylsulfanyl)aniline [French] [ACD/IUPAC Name]
N-[(2,4-dichlorophenyl)methyl]-3-(methylsulfanyl)aniline

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

Density: 1.3±0.0 g/cm3
Boiling Point: 426.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 68.1±0.0 kJ/mol
Flash Point: 211.6±0.0 °C
Index of Refraction: 1.644
Molar Refractivity: 82.0±0.0 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 4.85
ACD/BCF (pH 5.5): 2841.77
ACD/KOC (pH 5.5): 10315.91
ACD/LogD (pH 7.4): 4.85
ACD/BCF (pH 7.4): 2845.57
ACD/KOC (pH 7.4): 10329.69
Polar Surface Area: 37 Å2
Polarizability: 32.5±0.0 10-24cm3
Surface Tension: 52.8±0.0 dyne/cm
Molar Volume: 226.6±0.0 cm3

Click to predict properties on the Chemicalize site


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