Found 16 results

Search term: MF = 'C_{7}H_{7}IO_{3}S'
ChemSpider 2D Image | Methyl 3-hydroxy-4-iodo-5-methyl-2-thiophenecarboxylate | C7H7IO3S

Methyl 3-hydroxy-4-iodo-5-methyl-2-thiophenecarboxylate

  • Molecular FormulaC7H7IO3S
  • Average mass298.098 Da
  • Monoisotopic mass297.916046 Da
  • ChemSpider ID122685841

More details:

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

2-Thiophenecarboxylic acid, 3-hydroxy-4-iodo-5-methyl-, methyl ester [ACD/Index Name]
3-Hydroxy-4-iodo-5-méthyl-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-hydroxy-4-iodo-5-methyl-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-3-hydroxy-4-iod-5-methyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 284.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 125.7±27.3 °C
Index of Refraction: 1.650
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 166.02
ACD/KOC (pH 5.5): 1350.56
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 140.30
ACD/KOC (pH 7.4): 1141.35
Polar Surface Area: 75 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 57.8±3.0 dyne/cm
Molar Volume: 153.6±3.0 cm3

Click to predict properties on the Chemicalize site


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