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ChemSpider 2D Image | 1-(2-Chlorophenyl)-3-(3-isopropylphenyl)-1-methylthiourea | C17H19ClN2S

1-(2-Chlorophenyl)-3-(3-isopropylphenyl)-1-methylthiourea

  • Molecular FormulaC17H19ClN2S
  • Average mass318.864 Da
  • Monoisotopic mass318.095734 Da
  • ChemSpider ID31096875

More details:

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

1-(2-Chlorophenyl)-3-(3-isopropylphenyl)-1-methylthiourea [ACD/IUPAC Name]
1-(2-Chlorophényl)-3-(3-isopropylphényl)-1-méthylthiourée [French] [ACD/IUPAC Name]
1-(2-Chlorphenyl)-3-(3-isopropylphenyl)-1-methylthioharnstoff [German] [ACD/IUPAC Name]
Thiourea, N-(2-chlorophenyl)-N-methyl-N'-[3-(1-methylethyl)phenyl]- [ACD/Index Name]
1-(2-chlorophenyl)-1-methyl-3-[3-(propan-2-yl)phenyl]thiourea
1-(2-Chloro-phenyl)-3-(3-isopropyl-phenyl)-1-methyl-thiourea

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

Density: 1.2±0.1 g/cm3
Boiling Point: 404.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 198.2±31.5 °C
Index of Refraction: 1.667
Molar Refractivity: 96.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2376.34
ACD/KOC (pH 5.5): 9079.71
ACD/LogD (pH 7.4): 4.74
ACD/BCF (pH 7.4): 2376.28
ACD/KOC (pH 7.4): 9079.46
Polar Surface Area: 47 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 258.3±3.0 cm3

Click to predict properties on the Chemicalize site


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