ChemSpider 2D Image | 2-(1,3-Benzothiazol-2-yl)-N-methyl-1-(thieno[3,2-b]thiophen-2-yl)ethanamine | C16H14N2S3

2-(1,3-Benzothiazol-2-yl)-N-methyl-1-(thieno[3,2-b]thiophen-2-yl)ethanamine

  • Molecular FormulaC16H14N2S3
  • Average mass330.491 Da
  • Monoisotopic mass330.031921 Da
  • ChemSpider ID36362307

More details:

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

2-(1,3-Benzothiazol-2-yl)-N-methyl-1-(thieno[3,2-b]thiophen-2-yl)ethanamin [German] [ACD/IUPAC Name]
2-(1,3-Benzothiazol-2-yl)-N-methyl-1-(thieno[3,2-b]thiophen-2-yl)ethanamine [ACD/IUPAC Name]
2-(1,3-Benzothiazol-2-yl)-N-méthyl-1-(thiéno[3,2-b]thiophén-2-yl)éthanamine [French] [ACD/IUPAC Name]
2-Benzothiazoleethanamine, N-methyl-α-thieno[3,2-b]thien-2-yl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 502.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 257.9±30.1 °C
Index of Refraction: 1.751
Molar Refractivity: 97.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.20
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 116.22
ACD/KOC (pH 5.5): 285.84
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 4873.85
ACD/KOC (pH 7.4): 11986.96
Polar Surface Area: 110 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 63.2±3.0 dyne/cm
Molar Volume: 238.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement