ChemSpider 2D Image | 1-Chloro-4-[(3,3,3-trifluoropropyl)sulfanyl]benzene | C9H8ClF3S

1-Chloro-4-[(3,3,3-trifluoropropyl)sulfanyl]benzene

  • Molecular FormulaC9H8ClF3S
  • Average mass240.673 Da
  • Monoisotopic mass239.998734 Da
  • ChemSpider ID32863616

More details:






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

1-Chlor-4-[(3,3,3-trifluorpropyl)sulfanyl]benzol [German] [ACD/IUPAC Name]
1-Chloro-4-[(3,3,3-trifluoropropyl)sulfanyl]benzene [ACD/IUPAC Name]
1-Chloro-4-[(3,3,3-trifluoropropyl)sulfanyl]benzène [French] [ACD/IUPAC Name]
Benzene, 1-chloro-4-[(3,3,3-trifluoropropyl)thio]- [ACD/Index Name]
1707376-86-0 [RN]
1-Chloro-4-(3,3,3-trifluoro-propylsulfanyl)-benzene
MFCD26792615

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

Density: 1.3±0.1 g/cm3
Boiling Point: 248.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.6±3.0 kJ/mol
Flash Point: 104.1±27.3 °C
Index of Refraction: 1.508
Molar Refractivity: 53.8±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.51
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 893.84
ACD/KOC (pH 5.5): 4509.34
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 893.84
ACD/KOC (pH 7.4): 4509.34
Polar Surface Area: 25 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 34.3±5.0 dyne/cm
Molar Volume: 180.6±5.0 cm3

Click to predict properties on the Chemicalize site






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