ChemSpider 2D Image | 1-[(5-Chloro-2-methylphenyl)amino]-1-oxo-2-propanyl tetrahydro-3-thiophenecarboxylate 1,1-dioxide | C15H18ClNO5S

1-[(5-Chloro-2-methylphenyl)amino]-1-oxo-2-propanyl tetrahydro-3-thiophenecarboxylate 1,1-dioxide

  • Molecular FormulaC15H18ClNO5S
  • Average mass359.825 Da
  • Monoisotopic mass359.059418 Da
  • ChemSpider ID22563465

More details:

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

1,1-Dioxyde de tétrahydro-3-thiophènecarboxylate de 1-[(5-chloro-2-méthylphényl)amino]-1-oxo-2-propanyle [French] [ACD/IUPAC Name]
1-[(5-Chlor-2-methylphenyl)amino]-1-oxo-2-propanyl-tetrahydro-3-thiophencarboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
1-[(5-Chloro-2-methylphenyl)amino]-1-oxo-2-propanyl tetrahydro-3-thiophenecarboxylate 1,1-dioxide [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, tetrahydro-, 2-[(5-chloro-2-methylphenyl)amino]-1-methyl-2-oxoethyl ester, 1,1-dioxide [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: 596.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 314.3±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 85.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.60
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.03
ACD/KOC (pH 5.5): 275.82
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.03
ACD/KOC (pH 7.4): 275.82
Polar Surface Area: 98 Å2
Polarizability: 33.9±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 255.5±3.0 cm3

Click to predict properties on the Chemicalize site


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