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Search term: VXVOTMSSBAJGTN-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 5-Ethyl-N-(4-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide | C17H20N2OS

5-Ethyl-N-(4-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

  • Molecular FormulaC17H20N2OS
  • Average mass300.418 Da
  • Monoisotopic mass300.129639 Da
  • ChemSpider ID21686618

More details:

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

5-Ethyl-N-(4-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-carboxamid [German] [ACD/IUPAC Name]
5-Ethyl-N-(4-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide [ACD/IUPAC Name]
5-Éthyl-N-(4-pyridinylméthyl)-4,5,6,7-tétrahydro-1-benzothiophène-2-carboxamide [French] [ACD/IUPAC Name]
Benzo[b]thiophene-2-carboxamide, 5-ethyl-4,5,6,7-tetrahydro-N-(4-pyridinylmethyl)- [ACD/Index Name]
5-Ethyl-4,5,6,7-tetrahydro-benzo[b]thiophene-2-carboxylic acid (pyridin-4-ylmethyl)-amide
5-ethyl-N-(pyridin-4-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
MFCD06900178

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

Density: 1.2±0.1 g/cm3
Boiling Point: 481.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 245.2±28.7 °C
Index of Refraction: 1.590
Molar Refractivity: 87.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 228.78
ACD/KOC (pH 5.5): 1527.74
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 331.37
ACD/KOC (pH 7.4): 2212.77
Polar Surface Area: 70 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 257.6±3.0 cm3

Click to predict properties on the Chemicalize site


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