Found 46 results

Search term: MF = 'C_{6}H_{5}ClO_{3}S'
ChemSpider 2D Image | Methyl 5-chloro-3-hydroxy-2-thiophenecarboxylate | C6H5ClO3S

Methyl 5-chloro-3-hydroxy-2-thiophenecarboxylate

  • Molecular FormulaC6H5ClO3S
  • Average mass192.620 Da
  • Monoisotopic mass191.964798 Da
  • ChemSpider ID14639492

More details:

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

2-Thiophenecarboxylic acid, 5-chloro-3-hydroxy-, methyl ester [ACD/Index Name]
5-Chloro-3-hydroxy-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
953092-76-7 [RN]
Methyl 5-chloro-3-hydroxy-2-thiophenecarboxylate [ACD/IUPAC Name]
methyl 5-chloro-3-hydroxythiophene-2-carboxylate
Methyl-5-chlor-3-hydroxy-2-thiophencarboxylat [German] [ACD/IUPAC Name]
[953092-76-7] [RN]
1-iodylbenzene
5-Chlor-3-hydroxythiophen-2-carbonsaeuremethylester
5-Chloro-3-hydroxy-thiophene-2-carboxylic acid methyl ester
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 263.2±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.1±3.0 kJ/mol
    Flash Point: 113.0±25.9 °C
    Index of Refraction: 1.594
    Molar Refractivity: 43.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.86
    ACD/LogD (pH 5.5): 2.97
    ACD/BCF (pH 5.5): 106.49
    ACD/KOC (pH 5.5): 983.21
    ACD/LogD (pH 7.4): 2.94
    ACD/BCF (pH 7.4): 98.91
    ACD/KOC (pH 7.4): 913.17
    Polar Surface Area: 75 Å2
    Polarizability: 17.1±0.5 10-24cm3
    Surface Tension: 54.9±3.0 dyne/cm
    Molar Volume: 127.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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