ChemSpider 2D Image | 3-[(3-Ethoxypropyl){[5-(methylsulfonyl)-3-thienyl]carbonyl}amino]-2-methylpropanoic acid | C15H23NO6S2

3-[(3-Ethoxypropyl){[5-(methylsulfonyl)-3-thienyl]carbonyl}amino]-2-methylpropanoic acid

  • Molecular FormulaC15H23NO6S2
  • Average mass377.476 Da
  • Monoisotopic mass377.096680 Da
  • ChemSpider ID54646801

More details:

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

3-[(3-Ethoxypropyl){[5-(methylsulfonyl)-3-thienyl]carbonyl}amino]-2-methylpropanoic acid [ACD/IUPAC Name]
3-[(3-Ethoxypropyl){[5-(methylsulfonyl)-3-thienyl]carbonyl}amino]-2-methylpropansäure [German] [ACD/IUPAC Name]
Acide 3-[(3-éthoxypropyl){[5-(méthylsulfonyl)-3-thiényl]carbonyl}amino]-2-méthylpropanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-[(3-ethoxypropyl)[[5-(methylsulfonyl)-3-thienyl]carbonyl]amino]-2-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 630.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 335.1±31.5 °C
Index of Refraction: 1.541
Molar Refractivity: 92.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.35
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.80
ACD/LogD (pH 7.4): -2.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 292.9±3.0 cm3

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