ChemSpider 2D Image | Methyl 3-{[(2-thienylsulfonyl)acetyl]amino}-2-thiophenecarboxylate | C12H11NO5S3

Methyl 3-{[(2-thienylsulfonyl)acetyl]amino}-2-thiophenecarboxylate

  • Molecular FormulaC12H11NO5S3
  • Average mass345.414 Da
  • Monoisotopic mass344.979919 Da
  • ChemSpider ID21929379

More details:

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

2-Thiophenecarboxylic acid, 3-[[2-(2-thienylsulfonyl)acetyl]amino]-, methyl ester [ACD/Index Name]
3-{[2-(2-Thiénylsulfonyl)acétyl]amino}-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-{[(2-thienylsulfonyl)acetyl]amino}-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-3-{[(2-thienylsulfonyl)acetyl]amino}-2-thiophencarboxylat [German] [ACD/IUPAC Name]
1021046-60-5 [RN]
3-[2-(Thiophene-2-sulfonyl)-acetylamino]-thiophene-2-carboxylic acid methyl ester
methyl 3-(2-(thiophen-2-ylsulfonyl)acetamido)thiophene-2-carboxylate
METHYL 3-[2-(THIOPHENE-2-SULFONYL)ACETAMIDO]THIOPHENE-2-CARBOXYLATE
methyl 3-{[(2-thienylsulfonyl)acetyl]amino}thiophene-2-carboxylate
methyl 3-{[(thiophen-2-ylsulfonyl)acetyl]amino}thiophene-2-carboxylate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 642.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.4±31.5 °C
Index of Refraction: 1.635
Molar Refractivity: 80.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 13.05
ACD/KOC (pH 5.5): 218.86
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 13.05
ACD/KOC (pH 7.4): 218.84
Polar Surface Area: 154 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 66.6±3.0 dyne/cm
Molar Volume: 225.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement