ChemSpider 2D Image | Propyl 2-amino-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate | C15H16FNO2S

Propyl 2-amino-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate

  • Molecular FormulaC15H16FNO2S
  • Average mass293.356 Da
  • Monoisotopic mass293.088562 Da
  • ChemSpider ID21329916

More details:

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

2-Amino-4-(4-fluorophényl)-5-méthyl-3-thiophènecarboxylate de propyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-amino-4-(4-fluorophenyl)-5-methyl-, propyl ester [ACD/Index Name]
904998-66-9 [RN]
Propyl 2-amino-4-(4-fluorophenyl)-5-methyl-3-thiophenecarboxylate [ACD/IUPAC Name]
Propyl 2-amino-4-(4-fluorophenyl)-5-methylthiophene-3-carboxylate
Propyl-2-amino-4-(4-fluorphenyl)-5-methyl-3-thiophencarboxylat [German] [ACD/IUPAC Name]
VS-14281

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

MFCD02090966 [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 397.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.8±3.0 kJ/mol
    Flash Point: 194.5±27.9 °C
    Index of Refraction: 1.581
    Molar Refractivity: 79.3±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.99
    ACD/LogD (pH 5.5): 4.16
    ACD/BCF (pH 5.5): 860.72
    ACD/KOC (pH 5.5): 4389.10
    ACD/LogD (pH 7.4): 4.16
    ACD/BCF (pH 7.4): 860.73
    ACD/KOC (pH 7.4): 4389.11
    Polar Surface Area: 81 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 45.8±3.0 dyne/cm
    Molar Volume: 237.9±3.0 cm3

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