ChemSpider 2D Image | 1-[(4-Bromophenyl)sulfanyl]-4-(4-methoxyphenyl)-2-butanone | C17H17BrO2S

1-[(4-Bromophenyl)sulfanyl]-4-(4-methoxyphenyl)-2-butanone

  • Molecular FormulaC17H17BrO2S
  • Average mass365.285 Da
  • Monoisotopic mass364.013245 Da
  • ChemSpider ID71456980

More details:

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

1-[(4-Bromophenyl)sulfanyl]-4-(4-methoxyphenyl)-2-butanone [ACD/IUPAC Name]
1-[(4-Bromophényl)sulfanyl]-4-(4-méthoxyphényl)-2-butanone [French] [ACD/IUPAC Name]
1-[(4-Bromphenyl)sulfanyl]-4-(4-methoxyphenyl)-2-butanon [German] [ACD/IUPAC Name]
2-Butanone, 1-[(4-bromophenyl)thio]-4-(4-methoxyphenyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 459.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 231.5±27.3 °C
Index of Refraction: 1.622
Molar Refractivity: 92.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3102.02
ACD/KOC (pH 5.5): 10987.88
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3102.02
ACD/KOC (pH 7.4): 10987.88
Polar Surface Area: 52 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 52.6±5.0 dyne/cm
Molar Volume: 261.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement