Found 17 results

Search term: MF = 'C_{17}H_{16}ClNO_{7}S_{2}'
ChemSpider 2D Image | 2-(5-Chloro-2-thienyl)-2-oxoethyl N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)glycinate | C17H16ClNO7S2

2-(5-Chloro-2-thienyl)-2-oxoethyl N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)glycinate

  • Molecular FormulaC17H16ClNO7S2
  • Average mass445.894 Da
  • Monoisotopic mass445.005676 Da
  • ChemSpider ID21981168

More details:

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

2-(5-Chlor-2-thienyl)-2-oxoethyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)glycinat [German] [ACD/IUPAC Name]
2-(5-Chloro-2-thienyl)-2-oxoethyl N-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)glycinate [ACD/IUPAC Name]
Glycine, N-[(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)sulfonyl]-, 2-(5-chloro-2-thienyl)-2-oxoethyl ester [ACD/Index Name]
N-(3,4-Dihydro-2H-1,5-benzodioxépin-7-ylsulfonyl)glycinate de 2-(5-chloro-2-thiényl)-2-oxoéthyle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 640.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 341.2±34.3 °C
Index of Refraction: 1.599
Molar Refractivity: 102.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 123.81
ACD/KOC (pH 5.5): 1095.28
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 118.23
ACD/KOC (pH 7.4): 1045.93
Polar Surface Area: 145 Å2
Polarizability: 40.7±0.5 10-24cm3
Surface Tension: 57.1±3.0 dyne/cm
Molar Volume: 300.5±3.0 cm3

Click to predict properties on the Chemicalize site


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