ChemSpider 2D Image | N-{4-[(Trifluoromethyl)sulfanyl]phenyl}formamide | C8H6F3NOS

N-{4-[(Trifluoromethyl)sulfanyl]phenyl}formamide

  • Molecular FormulaC8H6F3NOS
  • Average mass221.199 Da
  • Monoisotopic mass221.012222 Da
  • ChemSpider ID48528702

More details:

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

Formamide, N-[4-[(trifluoromethyl)thio]phenyl]- [ACD/Index Name]
N-{4-[(Trifluormethyl)sulfanyl]phenyl}formamid [German] [ACD/IUPAC Name]
N-{4-[(Trifluoromethyl)sulfanyl]phenyl}formamide [ACD/IUPAC Name]
N-{4-[(Trifluorométhyl)sulfanyl]phényl}formamide [French] [ACD/IUPAC Name]
1494952-01-0 [RN]
24032-84-6 [RN]
4-(Trifluoromethylthio)phenyl isocyanate
MFCD21132407

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

MFCD00036025 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 255.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 108.5±27.3 °C
Index of Refraction: 1.526
Molar Refractivity: 48.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.41
ACD/BCF (pH 5.5): 39.93
ACD/KOC (pH 5.5): 487.30
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 39.93
ACD/KOC (pH 7.4): 487.30
Polar Surface Area: 54 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 39.5±5.0 dyne/cm
Molar Volume: 157.7±5.0 cm3

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