ChemSpider 2D Image | Methyl 2-amino-5-chloro-3-thiophenecarboxylate | C6H6ClNO2S

Methyl 2-amino-5-chloro-3-thiophenecarboxylate

  • Molecular FormulaC6H6ClNO2S
  • Average mass191.635 Da
  • Monoisotopic mass190.980774 Da
  • ChemSpider ID15413123

More details:

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

2-Amino-5-chloro-3-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
3-Thiophenecarboxylic acid, 2-amino-5-chloro-, methyl ester [ACD/Index Name]
55503-06-5 [RN]
Methyl 2-amino-5-chloro-3-thiophenecarboxylate [ACD/IUPAC Name]
METHYL 2-AMINO-5-CHLOROTHIOPHENE-3-CARBOXYLATE
Methyl-2-amino-5-chlor-3-thiophencarboxylat [German] [ACD/IUPAC Name]
CS-12409
methyl2-amino-5-chlorothiophene-3-carboxylate
MFCD20696783

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 298.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 53.8±3.0 kJ/mol
    Flash Point: 134.2±25.9 °C
    Index of Refraction: 1.612
    Molar Refractivity: 45.5±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 3.34
    ACD/LogD (pH 5.5): 2.55
    ACD/BCF (pH 5.5): 51.13
    ACD/KOC (pH 5.5): 581.64
    ACD/LogD (pH 7.4): 2.55
    ACD/BCF (pH 7.4): 51.13
    ACD/KOC (pH 7.4): 581.64
    Polar Surface Area: 81 Å2
    Polarizability: 18.1±0.5 10-24cm3
    Surface Tension: 55.1±3.0 dyne/cm
    Molar Volume: 131.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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