ChemSpider 2D Image | Methyl 4-(chlorosulfonyl)-5-methyl-2-thiophenecarboxylate | C7H7ClO4S2

Methyl 4-(chlorosulfonyl)-5-methyl-2-thiophenecarboxylate

  • Molecular FormulaC7H7ClO4S2
  • Average mass254.711 Da
  • Monoisotopic mass253.947433 Da
  • ChemSpider ID53608785

More details:

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

2-Thiophenecarboxylic acid, 4-(chlorosulfonyl)-5-methyl-, methyl ester [ACD/Index Name]
4-(Chlorosulfonyl)-5-méthyl-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-(chlorosulfonyl)-5-methyl-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-4-(chlorsulfonyl)-5-methyl-2-thiophencarboxylat [German] [ACD/IUPAC Name]
1565929-24-9 [RN]
methyl 4-(chlorosulfonyl)-5-methylthiophene-2-carboxylate
methyl4-(chlorosulfonyl)-5-methylthiophene-2-carboxylate
MFCD26078401

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

Density: 1.5±0.1 g/cm3
Boiling Point: 381.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.0±3.0 kJ/mol
Flash Point: 184.7±27.9 °C
Index of Refraction: 1.553
Molar Refractivity: 54.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.89
ACD/KOC (pH 5.5): 414.92
ACD/LogD (pH 7.4): 2.28
ACD/BCF (pH 7.4): 31.89
ACD/KOC (pH 7.4): 414.92
Polar Surface Area: 97 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 169.7±3.0 cm3

Click to predict properties on the Chemicalize site


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