PLANNED MAINTENANCE

There will be scheduled maintenance work beginning on Wednesday 26th February 2020 from 11:00 AM through to 12.00 PM (GMT).

During this time, you may not be able to log into ChemSpider. We apologise for any inconvenience this might cause and thank you for your patience.


ChemSpider 2D Image | 2-Octyl-4,7-di(2-thienyl)-2H-benzotriazole | C22H25N3S2

2-Octyl-4,7-di(2-thienyl)-2H-benzotriazole

  • Molecular FormulaC22H25N3S2
  • Average mass395.584 Da
  • Monoisotopic mass395.148987 Da
  • ChemSpider ID24785757

More details:






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

2H-1,2,3-Benzotriazole, 2-octyl-4,7-di-2-thienyl- [ACD/Index Name]
2-Octyl-4,7-di(2-thienyl)-2H-benzotriazol [German] [ACD/IUPAC Name]
2-Octyl-4,7-di(2-thienyl)-2H-benzotriazole [ACD/IUPAC Name]
2-Octyl-4,7-di(2-thiényl)-2H-benzotriazole [French] [ACD/IUPAC Name]
1254062-40-2 [RN]
2-Octyl-4,7-di (thiophen-2-yl)-2H-benzo[d][1,2,3]triazole
2-Octyl-4,7-di(thiophen-2-yl)-2H-benzo[d][1,2,3]triazole

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 568.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.3±32.9 °C
Index of Refraction: 1.665
Molar Refractivity: 119.2±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 8.31
ACD/LogD (pH 5.5): 8.03
ACD/BCF (pH 5.5): 742046.19
ACD/KOC (pH 5.5): 554124.69
ACD/LogD (pH 7.4): 8.03
ACD/BCF (pH 7.4): 742144.00
ACD/KOC (pH 7.4): 554197.75
Polar Surface Area: 87 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 49.1±7.0 dyne/cm
Molar Volume: 320.9±7.0 cm3

Click to predict properties on the Chemicalize site






Advertisement