ChemSpider 2D Image | N-(3-Chlorophenyl)thioformamide | C7H6ClNS

N-(3-Chlorophenyl)thioformamide

  • Molecular FormulaC7H6ClNS
  • Average mass171.647 Da
  • Monoisotopic mass170.990952 Da
  • ChemSpider ID60748405

More details:

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

Methanethioamide, N-(3-chlorophenyl)- [ACD/Index Name]
N-(3-Chlorophenyl)thioformamide [ACD/IUPAC Name]
N-(3-Chlorophényl)thioformamide [French] [ACD/IUPAC Name]
N-(3-Chlorphenyl)thioformamid [German] [ACD/IUPAC Name]
26060-42-4 [RN]
MFCD20662539

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

Density: 1.4±0.1 g/cm3
Boiling Point: 246.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.4±3.0 kJ/mol
Flash Point: 102.9±27.9 °C
Index of Refraction: 1.691
Molar Refractivity: 48.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 2.80
ACD/BCF (pH 5.5): 78.33
ACD/KOC (pH 5.5): 789.36
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 78.13
ACD/KOC (pH 7.4): 787.40
Polar Surface Area: 44 Å2
Polarizability: 19.1±0.5 10-24cm3
Surface Tension: 61.1±3.0 dyne/cm
Molar Volume: 126.0±3.0 cm3

Click to predict properties on the Chemicalize site


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