ChemSpider 2D Image | {2-(2-Butoxy-2-oxoethoxy)-4-[N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonyl)glycyl]phenoxy}acetic acid | C24H28N2O8S

{2-(2-Butoxy-2-oxoethoxy)-4-[N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonyl)glycyl]phenoxy}acetic acid

  • Molecular FormulaC24H28N2O8S
  • Average mass504.553 Da
  • Monoisotopic mass504.156647 Da
  • ChemSpider ID8273161

More details:

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

{2-(2-Butoxy-2-oxoethoxy)-4-[N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonyl)glycyl]phenoxy}acetic acid [ACD/IUPAC Name]
{2-(2-Butoxy-2-oxoethoxy)-4-[N-(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-ylcarbonyl)glycyl]phenoxy}essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2,2'-[[4-[2-[[(4,5,6,7-tetrahydrothieno[3,2-c]pyridin-2-yl)carbonyl]amino]acetyl]-1,2-phenylene]bis(oxy)]bis-, butyl ester [ACD/Index Name]
Acide {2-(2-butoxy-2-oxoéthoxy)-4-[N-(4,5,6,7-tétrahydrothiéno[3,2-c]pyridin-2-ylcarbonyl)glycyl]phénoxy}acétique [French] [ACD/IUPAC 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: 711.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.2±3.0 kJ/mol
Flash Point: 383.9±32.9 °C
Index of Refraction: 1.582
Molar Refractivity: 127.9±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 1.60
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.95
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 169 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 383.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement