ChemSpider 2D Image | 5-(Methoxycarbonyl)-2,3-dihydro-2-thiophenecarboxylate | C7H7O4S

5-(Methoxycarbonyl)-2,3-dihydro-2-thiophenecarboxylate

  • Molecular FormulaC7H7O4S
  • Average mass187.194 Da
  • Monoisotopic mass187.007050 Da
  • ChemSpider ID57555173

  • Charge - Charge

More details:

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

2,5-Thiophenedicarboxylic acid, 2,3-dihydro-, 5-methyl ester, ion(1-) [ACD/Index Name]
5-(Methoxycarbonyl)-2,3-dihydro-2-thiophencarboxylat [German] [ACD/IUPAC Name]
5-(Methoxycarbonyl)-2,3-dihydro-2-thiophenecarboxylate [ACD/IUPAC Name]
5-(Méthoxycarbonyl)-2,3-dihydro-2-thiophènecarboxylate [French] [ACD/IUPAC Name]
5-(Methoxycarbonyl)-2,3-dihydrothiophene-2-carboxylate
85196-27-6 [RN]

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

Density:
Boiling Point: 387.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.9±6.0 kJ/mol
Flash Point: 188.2±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.49
ACD/LogD (pH 5.5): -1.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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